| MolPort-020-904-412 |
1 |
CC(O)C1CC(C)CCN1
|
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| MolPort-016-635-538 |
1 |
CC(O)C1CCCCN1
|
|
| MolPort-020-088-284 |
1 |
CCC(O)C1CCCCN1
|
|
| MCULE-7730134295 |
1 |
CCC(C1NCCCC1)O
|
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| MCULE-7899504390 |
1 |
N1CCCCC1C(O)C(C)C
|
|
| MCULE-2559324365 |
1 |
CC(C1NCCCC1)O
|
|
| MCULE-6643036551 |
1 |
CC(C1NCCCC1)(O)C
|
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| MCULE-3956598895 |
1 |
CC(C1(NCCCC1)C)O
|
|
| MCULE-5108907440 |
1 |
CCC(C1(NCCCC1)C)O
|
|
| MCULE-4524494368 |
1 |
C(O)(C1CCCCN1)C(C)(C)C
|
|
| MCULE-6816426503 |
1 |
CC(C1NCCC(C)C1)O
|
|
| MCULE-9163032708 |
1 |
CC(C(C1(NCCCC1)C)O)C
|
|
| MCULE-3254363836 |
1 |
CC(C(C1(NCCCC1)C)O)(C)C
|
|
| MCULE-6585488726 |
0.97 |
CC(C(C(C1(NCCCC1)C)O)C)C
|
|
| MCULE-6435128406 |
0.97 |
CC(CC(C1(NCCCC1)C)O)C
|
|
| MCULE-8918854525 |
0.97 |
Cl.CC(C1NCCCC1)(O)C
|
|
| MCULE-2247078370 |
0.97 |
CCC(C(C1(NCCCC1)C)O)C
|
|
| MCULE-9001700701 |
0.97 |
CC(C1N(C)CCCC1)O
|
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| MCULE-8012381412 |
0.97 |
CN1C(C(C(C)(C)C)O)CCCC1
|
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| MCULE-8221444737 |
0.97 |
CCC(C(C1N(C)CCCC1)O)C
|
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| MCULE-7341342217 |
0.97 |
CCCC(C1N(C)CCCC1)O
|
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| MCULE-8099956753 |
0.97 |
CC(CC(C1N(C)CCCC1)O)C
|
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| MCULE-6891358620 |
0.97 |
CCCC(C1(NCCCC1)C)O
|
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| MCULE-6881192113 |
0.97 |
N1CCCCC1C(O)CC(C)C
|
|
| MCULE-5350631518 |
0.97 |
N1CCCCC1C(CCC)O
|
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| MCULE-7851226321 |
0.97 |
CCC(C1N(C)CCCC1)O
|
|
| MCULE-6211007167 |
0.97 |
CC(C(C(C1N(C)CCCC1)O)C)C
|
|
| MCULE-1667966441 |
0.97 |
C[C@H]1N[C@@H](CO)CCC1
|
|
| MCULE-1132392693 |
0.97 |
CC1NC(CO)CCC1
|
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| MolPort-045-971-458 |
0.97 |
Cl.CC(C)(O)C1CCCCN1
|
|
| MolPort-029-002-637 |
0.97 |
OC1(CC1)C1CCCCN1
|
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| MolPort-046-673-976 |
0.97 |
CC(C)(C)C1CCC(CO)NC1
|
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| MolPort-044-203-378 |
0.97 |
C[C@@H]1CCC[C@H](CO)N1
|
|
| MolPort-023-313-441 |
0.97 |
CC1CCCC(CO)N1
|
|
| MCULE-8938774016 |
0.94 |
CC(C1N(CC2CCC(C)CC2)CCCC1)O
|
|
| MCULE-9140933720 |
0.94 |
CC1(C(C2CCCC2)O)NCCCC1
|
|
| MCULE-7865063466 |
0.94 |
OC(C1NCCCC1)CC1CCC1
|
|
| MCULE-3628581594 |
0.94 |
N1(CCCCC1)C1CCCCCC1O
|
|
| MCULE-1741672749 |
0.94 |
N1(CCCCC1CO)C1CCCCCC1
|
|
| MCULE-8708656390 |
0.94 |
CC1(C(CC2CC2)O)NCCCC1
|
|
| MCULE-7351303757 |
0.94 |
N1(CCCCC1CO)C1CCC(CC1)C
|
|
| MCULE-9390145655 |
0.94 |
CC1(C(C2CC2)O)NCCCC1
|
|
| MCULE-8685669236 |
0.94 |
N1(CCCCC1CO)C1CCC(CC1)CC
|
|
| MCULE-4973909112 |
0.94 |
CC1(C(CC2CCC2)O)NCCCC1
|
|
| MCULE-9345873088 |
0.94 |
CC1(C(C2CCC2)O)NCCCC1
|
|
| MCULE-3220474582 |
0.94 |
N1(CCCCC1CO)C1CCC(CC1)C(C)(C)C
|
|
| MCULE-7794088762 |
0.94 |
CC1(C(N2CCCCC2)CCCC1)O
|
|
| MCULE-6224290980 |
0.94 |
CN1C(C(CC2CCC2)O)CCCC1
|
|
| MCULE-4956765768 |
0.94 |
CN1C(C(C2CCCC2)O)CCCC1
|
|
| MCULE-4209503470 |
0.94 |
OC(C12CC3CC(CC(C3)C1)C2)CN1CCCCC1
|
|
| MCULE-9041155657 |
0.94 |
OC1C2CC(CCN2)CC1
|
|
| MCULE-7712694099 |
0.94 |
CCC(C1NC2C(CCCC2)CC1)O
|
|
| MCULE-3341549300 |
0.94 |
CN1C(C(C2CCC2)O)CCCC1
|
|
| MCULE-1273113446 |
0.94 |
CN1C(C(CC2CC2)O)CCCC1
|
|
| MCULE-3169202097 |
0.94 |
C[C@@]1([C@H](N2CCCCC2)CCCC1)O
|
|
| MCULE-2100962348 |
0.94 |
CC1(CCC1)CC(C1NCCCC1)O
|
|
| MCULE-7108192618 |
0.94 |
C1(C(O)C2CCCCN2)CC1
|
|
| MCULE-1765746777 |
0.94 |
C12(CCC(NC1)CO)CC2
|
|
| MCULE-1384605042 |
0.94 |
C1(CC1)C(C)(O)C1CCCCN1
|
|
| MCULE-4825418570 |
0.94 |
C1(CC(O)C2CCCCN2)CC1
|
|
| MCULE-9166695190 |
0.94 |
O[C@H]1[C@@H]2C[C@H](CCN2)CC1
|
|
| MCULE-3251376279 |
0.94 |
C[C@H]1[C@@H](CO)NCCC1
|
|
| MCULE-4408087733 |
0.94 |
CC1C(CO)NCCC1
|
|
| MCULE-1585224164 |
0.94 |
OC[C@@H]1NCCCC1
|
|
| MCULE-6170192975 |
0.94 |
OC[C@@H]1CCCCN1
|
|
| MCULE-2860177964 |
0.94 |
OC[C@H]1CCCCN1
|
|
| MCULE-5190999833 |
0.94 |
OCC1NCCCC1
|
|
| MCULE-2480758252 |
0.94 |
CC1(NCCCC1)CO
|
|
| MCULE-7805438267 |
0.94 |
N1CCCC[C@H]1CO
|
|
| MolPort-031-118-228 |
0.94 |
OCC1CCCCN1C1CCCCCC1
|
|
| MolPort-046-140-343 |
0.94 |
OC1CCC2CCNC1C2
|
|
| MolPort-029-242-427 |
0.94 |
OCC12CCC(CC1)CN2
|
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| MolPort-007-996-824 |
0.94 |
OC(CN1CCCCC1)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-042-622-822 |
0.94 |
OCC1CCC2(CCCC2)CN1
|
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| MolPort-042-579-818 |
0.94 |
CCCN(C)CC1(O)CCC2(CCNCC2)CC1
|
|
| MolPort-029-910-368 |
0.94 |
CC(O)C1CCCCN1CC1CCC(C)CC1
|
|
| MolPort-021-537-221 |
0.94 |
CC1CCC(CC1)N1CCCCC1CO
|
|
| MolPort-004-791-945 |
0.94 |
CCC1CCC(CC1)N1CCCCC1CO
|
|
| MolPort-045-968-290 |
0.94 |
CC(C)(C)C1CCC(CC1)N1CCCCC1CO
|
|
| MolPort-046-510-385 |
0.94 |
Cl.CN1CCCCC1C(C)(C)O
|
|
| MolPort-008-327-677 |
0.94 |
OC1CCCCCC1N1CCCCC1
|
|
| MolPort-042-684-001 |
0.94 |
CC1(C)CCC(CO)NC1
|
|
| MolPort-028-951-020 |
0.94 |
CC1CCCNC1CO
|
|
| MolPort-000-148-394 |
0.94 |
OCC1CCCCN1
|
|
| MolPort-019-937-995 |
0.94 |
CC1(CO)CCCCN1
|
|
| MolPort-009-683-158 |
0.94 |
OC[C@@H]1CCCCN1
|
|
| MolPort-019-879-036 |
0.94 |
OC[C@H]1CCCCN1
|
|
| MolPort-046-686-596 |
0.91 |
Cl.OC1(CCC1)C1CCCCN1
|
|
| MolPort-039-136-897 |
0.91 |
Cl.OCC12CCC(CC1)CN2
|
|
| MolPort-045-987-768 |
0.91 |
Cl.O[C@@H]1CC[C@H]2CCN[C@H]1C2
|
|
| MolPort-038-353-230 |
0.91 |
OCC12CCCN1CCCC2
|
|
| MolPort-038-967-625 |
0.91 |
OC[C@H]1CCCCN1CC(O)CC1CCCC1
|
|
| MolPort-046-766-880 |
0.91 |
OC1CCC2(CCC2)NC1
|
|
| MolPort-042-579-817 |
0.91 |
OC1(CN2CCCC2)CCC2(CCNCC2)CC1
|
|
| MolPort-002-254-642 |
0.91 |
Cl.OC(CN1CCCCC1)C12CC3CC(CC(C3)C1)C2
|
|
| MCULE-9807666207 |
0.91 |
OC[C@@]12NCCC[C@@H]1C2
|
|
| MCULE-5371316530 |
0.91 |
Cl.O[C@H]1[C@@H]2C[C@H](CCN2)CC1
|
|
| MCULE-9616592027 |
0.91 |
C12(CO)NCCCC1C2
|
|
| MCULE-7934553166 |
0.91 |
Cl[H].C12(CC3CC(CC(C3)C1)C2)C(O)CN1CCCCC1
|
|
| MCULE-6038824124 |
0.91 |
OC[C@@H]1N(CC(CC2CCCC2)O)CCCC1
|
|
| MCULE-1172154600 |
0.91 |
CC(C1N(CC2CCNCC2)CCC(C)C1)O
|
|
| MCULE-4018673309 |
0.91 |
CCC(C(NCC1(CCCCCC1)O)C)C
|
|
| MCULE-6493849254 |
0.91 |
CCCC(NCC1(CCCCC1)O)CC
|
|
| MCULE-1586506984 |
0.91 |
N1CCCCCC1CO
|
|
| MCULE-9988354874 |
0.91 |
N(C(CCCC)CO)C1CCCC(C)(C)C1
|
|
| MCULE-7723704693 |
0.91 |
CCC(N([C@H]1[C@@](O)(C)CCCC1)C)C
|
|
| MCULE-4224989564 |
0.91 |
N1(CCC(CC1)C)[C@H]1CCCC[C@@H]1O
|
|
| MCULE-5172806018 |
0.91 |
CC(CNC1C(O)(C)CCCC1)C
|
|
| MCULE-7161240879 |
0.91 |
CCC(NCC1(CCCCCC1)O)CC
|
|
| MCULE-9018305223 |
0.91 |
CCC(N(C1C(O)(C)CCCC1)C)C
|
|
| MCULE-7992858016 |
0.91 |
Cl.C[C@H]1[C@@H](CO)NCCC1
|
|
| MCULE-5836896406 |
0.91 |
CCC(N[C@H]1[C@@](O)(C)CCCC1)(C)C
|
|
| MCULE-8007402108 |
0.91 |
CCC(NC1C(O)(C)CCCC1)(C)C
|
|
| MCULE-3549397024 |
0.91 |
CC(CNC1C(O)(C)CCCC1)(C)C
|
|
| MCULE-7171011505 |
0.91 |
CC(CN([C@H]1[C@@](O)(C)CCCC1)C)C
|
|
| MCULE-7334385198 |
0.91 |
CC(CN(C1C(O)(C)CCCC1)C)C
|
|
| MCULE-1841662516 |
0.91 |
CCC(CNCC1(CCCCCC1)O)C
|
|
| MCULE-5573191865 |
0.91 |
CC(CCC(NCC1(CCCCC1)O)C)C
|
|
| MCULE-1080178494 |
0.91 |
C1(CCCCC1)(O)CNC1CCCCC1
|
|
| MCULE-5386536148 |
0.91 |
CC(CC(NCC1(CCCCCC1)O)C)C
|
|
| MCULE-6984585002 |
0.91 |
CC(C(N[C@H]1[C@@](O)(C)CCCC1)C)C
|
|
| MCULE-5842667782 |
0.91 |
CC(C(NC1C(O)(C)CCCC1)C)C
|
|
| MCULE-3068262302 |
0.91 |
N1CCCCC[C@H]1CO
|
|
| MCULE-6380679690 |
0.91 |
CC(CCNCC1(CCCCCC1)O)(C)C
|
|
| MCULE-8075113527 |
0.91 |
CC(CCNCC1(CCCCC1)O)(C)C
|
|
| MCULE-5328877020 |
0.91 |
CC1CC(NCC2(CCCCC2)O)CCC1
|
|
| MCULE-4571891158 |
0.91 |
C12(CC3CC(CC(C3)C1)C2)C(O)C(C)NC1CCCCC1
|
|
| MCULE-9818940235 |
0.91 |
CC(CN[C@H]1[C@@](O)(C)CCCC1)(C)C
|
|
| MCULE-1130160987 |
0.91 |
C12(C(CO)NCC(C)(C)C)CC3CC(CC(C3)C1)C2
|
|
| MCULE-6242797269 |
0.91 |
CCC(C(C)C)NCC1(CCCCCC1)O
|
|
| MCULE-7178308378 |
0.91 |
CC(C1NC(C2CC2)CC1)O
|
|
| MCULE-7793317950 |
0.91 |
CC(C(NCC1(CCCCCC1)O)C)C
|
|
| MCULE-9130702365 |
0.91 |
CC1C(NCC2(CCCCC2)O)CCCC1
|
|
| MCULE-1477969494 |
0.91 |
CCC(NC1C(O)(C)CCCC1)C
|
|
| MCULE-3096796794 |
0.91 |
CC(CN[C@H]1[C@@](O)(C)CCCC1)C
|
|
| MCULE-6420465392 |
0.91 |
CCCN(C1C(O)(C)CCCC1)C
|
|
| MCULE-4378563681 |
0.91 |
OC1(CCCCC1)CNCC1CCCCC1
|
|
| MCULE-5459244281 |
0.91 |
CCCN[C@H]1[C@@](O)(C)CCCC1
|
|
| MCULE-3207739044 |
0.91 |
CCCCC(NCC1(CCCCC1)O)C
|
|
| MCULE-9392450597 |
0.91 |
N1(CCCCCC1CO)CC
|
|
| MCULE-2095430523 |
0.91 |
CCCN([C@H]1[C@@](O)(C)CCCC1)C
|
|
| MCULE-5441256344 |
0.91 |
CCC(C1NC(C2CC2)CC1)O
|
|
| MCULE-6580150494 |
0.91 |
CCCNC1C(O)(C)CCCC1
|
|
| MCULE-9385169483 |
0.91 |
CC(C(C1NC(C2CC2)CC1)O)C
|
|
| MCULE-9312314335 |
0.91 |
O[C@@H]1[C@@H](N2CCCCC2)CCCC1
|
|
| MCULE-2145227425 |
0.91 |
CCCC1CCC(NCC2(CCCCC2)O)CC1
|
|
| MCULE-7681794650 |
0.91 |
CC(C(C1NC(C2CC2)CC1)O)(C)C
|
|
| MCULE-5556844446 |
0.91 |
CC(CNCC1(CCCCCC1)O)(C)C
|
|
| MCULE-5489168478 |
0.91 |
CCC1CCC(NC2C(O)CCCC2)CC1
|
|
| MCULE-9694303003 |
0.91 |
CCC(CC(NC1C(O)CCCC1)CC)C
|
|
| MCULE-3729338028 |
0.91 |
N(C(CCCC)CO)C1CCCCCC1
|
|
| MCULE-2660613044 |
0.91 |
C1(CCCO)CCN(CCO)CC1
|
|
| MCULE-3375922888 |
0.91 |
CC[C@H]1C[C@@H](CO)NCC1
|
|
| MCULE-8637862968 |
0.91 |
N12CCC(CC1)CC2CO
|
|
| MCULE-7433359891 |
0.91 |
N1(CCCCC1CO)C
|
|
| MCULE-4169808027 |
0.91 |
C([C@H]1CCCCN1C)O
|
|
| MCULE-6512254506 |
0.91 |
C([C@@H]1CCCCN1C)O
|
|
| MCULE-9707891464 |
0.91 |
CCN1C(CO)CCCC1
|
|
| MCULE-5720351306 |
0.91 |
C([C@@H]1CCCCN1C)O
|
|
| MCULE-5806828736 |
0.91 |
C([C@H]1CCCCN1C)O
|
|
| MCULE-4992390900 |
0.91 |
Cl.N1CCCCC1(C)CO
|
|
| MCULE-9080964771 |
0.91 |
Cl.N1CCCC[C@@H]1CO
|
|
| MolPort-046-699-484 |
0.91 |
Cl.C[C@@H]1CC[C@@H](CO)NC1
|
|
| MolPort-008-382-171 |
0.91 |
CCCCC(CO)NC1CCCC(C)(C)C1
|
|
| MolPort-016-585-912 |
0.91 |
OCC1CCCCCN1
|
|
| MolPort-014-125-264 |
0.91 |
CCCC1CCC(CC1)NCC1(O)CCCCC1
|
|
| MolPort-012-799-845 |
0.91 |
CCCCC(CO)NC1CCCCCC1
|
|
| MolPort-006-118-893 |
0.91 |
O[C@H]1CCCC[C@@H]1N1CCCCC1
|
|
| MolPort-002-084-334 |
0.91 |
CCN1CCCCCC1CO
|
|
| MolPort-044-188-301 |
0.91 |
CC1CCN(CC1)[C@H]1CCCC[C@@H]1O
|
|
| MolPort-044-203-228 |
0.91 |
Cl.C[C@@H]1CCCN[C@@H]1CO
|
|
| MolPort-046-420-116 |
0.91 |
Cl.OC[C@H]1CCC[C@@H](CO)N1
|
|
| MolPort-002-582-943 |
0.91 |
CC(NC1CCCCC1)C(O)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-039-332-585 |
0.91 |
Cl.CC1CCC(CO)NC1
|
|
| MolPort-006-123-041 |
0.91 |
OCCCC1CCN(CCO)CC1
|
|
| MolPort-001-791-411 |
0.91 |
CN1CCCCC1CO
|
|
| MolPort-029-245-850 |
0.91 |
OCC1CC2CCN1CC2
|
|
| MolPort-011-939-673 |
0.91 |
CCN1CCCCC1CO
|
|
| MolPort-023-278-953 |
0.91 |
CN1CCCC[C@H]1CO
|
|
| MolPort-042-684-256 |
0.91 |
Cl.C[C@@H]1CCN[C@H](CO)C1
|
|
| MolPort-029-242-426 |
0.91 |
OCC12CC(C1)CCN2
|
|
| MolPort-044-832-298 |
0.91 |
OCC1(CO)CCCCN1
|
|
| MolPort-046-774-893 |
0.91 |
CC(C)(C)[C@@H]1CCN[C@H](CO)C1
|
|
| MolPort-023-278-952 |
0.91 |
CN1CCCC[C@@H]1CO
|
|
| MolPort-046-415-729 |
0.91 |
CC[C@@H]1CCN[C@H](CO)C1
|
|
| MolPort-029-997-909 |
0.91 |
Cl.CC1(CO)CCCCN1
|
|
| MCULE-5494433933 |
0.89 |
CC1CC(C2CCCCC2)(O)CNC1
|
|
| MCULE-6838204313 |
0.89 |
CC1CC(CC2CCCC2)(O)CNC1
|
|
| MCULE-6587154445 |
0.89 |
OC1CC2(CCCC2)CNC1
|
|
| MCULE-1285981370 |
0.89 |
OC1C2NCC(CC2)C1
|
|
| MCULE-3280153542 |
0.89 |
CC1CCC(CN2CCC(CO)CC2)(O)CC1
|
|
| MCULE-1746949150 |
0.89 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@H](O)[C@@H](N5CCCCC5)C[C@]34C)[C@]1([H])C[C@H](N1CCCCC1)[C@@H]2O)[H]
|
|
| MCULE-9522521209 |
0.89 |
CC(CN1CCC(CN(CC2(CCCCC2)O)C)CC1)O
|
|
| MCULE-6501544962 |
0.89 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])C[C@H](O)[C@@H](N5CCCCC5)C[C@]34C)[C@]1([H])C[C@H](N1CCCCC1)[C@@H]2O)[H]
|
|
| MCULE-9901444845 |
0.89 |
CN(CC1(CCCCC1)O)CC1CCN(CCO)CC1
|
|
| MCULE-3338061728 |
0.89 |
N1(CCCCC1CCO)CCO
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CC(CN1CCC(CNCC2(CCCCC2)O)CC1)O
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CC1(C(N2CC3C(C3)C2)CCCC1)O
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OCCN1CCC(CNCC2(CCCCC2)O)CC1
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O[C@H]1[C@H]2CC[C@@H](O)[C@H](N2)CC1
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OC1(C2CCN(CC2)C1)CCC1CC1
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OC(C1NCCCC1)C1CC2C(C2)C1
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Cl.OC[C@@]12NCCC[C@@H]1C2
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OC1(C2CCCC2)C2CCN(CC2)C1
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OCC1(N2CC3C(C3)C2)CCCCC1
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CC1CC(CCC2CC2)(O)CNC1
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N1(CCC(CC1)CN)CC1(O)CCC(CC1)C
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CC1CC(NCC2CCNCC2)(CO)CC(C)(C)C1
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CC1CC(C2CCCC2)(O)CNC1
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C[C@@]1([C@H](N2CC3C(C3)C2)CCCC1)O
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CN([C@H]1[C@@](O)(C)CCCC1)C1CCC1
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CC(CCC1(C2CCN(CC2)C1)O)C
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CCCCC1(C2CCN(CC2)C1)O
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CC1CN(C2C(O)(C)CCCC2)CC1
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CC1(C(NC2CC2)CCCC1)O
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CC1(CC1)CN[C@H]1[C@@](O)(C)CCCC1
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C[C@@]1([C@H](NC2CCCC2)CCCC1)O
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CC1C(NC2CC2)(CO)CCCCC1
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CC(CC(C1(CC(C)CNC1)O)C)C
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C[C@@]1([C@H](NCC2CCC2)CCCC1)O
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CC(CCC1(CC(C)CNC1)O)C
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CCCCC1(CC(C)CNC1)O
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CC1(N[C@H]2[C@@](O)(C)CCCC2)CCC1
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CCC1CN(C2C(O)(C)CCCC2)C1
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CC1CN(C2C(O)(C)CCCC2)C1
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C[C@H](CNCC(C1CCCCC1)(O)C)O
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CC1(CN(C2C(O)(C)CCCC2)C1)C
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OC1C(NC2C3C4C(C(C3)C2)CCC4)CCCC1
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OC(C1NCCCCC1)CC1CC1
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CN(C1C(O)(C)CCCC1)CC1CC1
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CCN(C1C(O)(C)CCCC1)C1CC1
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OCC1(NC2CC2)CCC2(CC2)CC1
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CC1(C(NCC2CC2)CCCC1)O
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CC1CN(C2(CCCCC2)CO)CC1
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CN(C1C(O)(C)CCCC1)C1CC1
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CC1(C(N2CCCC2)CCCC1)O
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CC1(NC2C(O)(C)CCCC2)CC1
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CC1(C(N2CCC2)CCCC1)O
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CCC(CC1(CC(C)CNC1)O)C
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CC1CC(CCC(C)(C)C)(O)CNC1
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C1(CCCCC1)(CNCC(C)O)O
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C12C(C1)CNCC(O)C2
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CC1C(CNC2CC2)(O)CCCCC1
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CC1C(NC2C(O)(C)CCCC2)CC1
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CC(CN[C@H]1[C@@](O)(C)CCCC1)(O)C
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CC1(C(NC2C(O)(C)CCCC2)C1)C
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CC(CNC1C(O)(C)CCCC1)O
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CC1(CC1)CNC1C(O)(C)CCCC1
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C12(C(CO)NCC(C)(C)C)CC3CC(CC(C3)C1)C2.Cl
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CC(CN(C1C(O)(C)CCCC1)C)O
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CC(CN([C@H]1[C@@](O)(C)CCCC1)C)O
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CC1(C(NC2CCCC2)CCCC1)O
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C[C@@]1([C@H](N2CCC2)CCCC1)O
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CN(C1(CCCCC1)CO)C1CCC1
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CCC1C(NC2C(O)(C)CCCC2)C1
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CC1(C(NCC2CCC2)CCCC1)O
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CC1CC(NC2C(O)(C)CCCC2)C1
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CC1(NC2C(O)(C)CCCC2)CCC1
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CC([C@H](NCC1(CCC(C)CC1)O)CO)C
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CC1C(CNC2C(O)(C)CCCC2)C1
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CN([C@H]1[C@@](O)(C)CCCC1)C1CC1
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CC(C1CC1)NC1C(O)(C)CCCC1
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OC(C1NCCC1)CC1CCNCC1
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C1C(CO)(N2CCCC2)CCCC1
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N1(CC(O)CC(CC(O)C1)C(C)(C)C)C(C)(C)C
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OC1(CCCCCC1)CNC1CCCCC1
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C12(CC3CC(CC(C3)C1)C2)C(O)CN1CCCC1
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CN([C@H]1[C@@](O)(C)CCCC1)CC1CC1
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Cl.C12(CC3CC(CC(C3)C1)C2)C(O)C(C)NC1CCCCC1
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OC1(CCCCCC1)CNC1CCCC1
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C1(CCCCC1)(O)CNC1CCCC1
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CC(CNC1C(O)(C)CCCC1)(O)C
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CCC(C(C1(CC(C)CNC1)O)C)C
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CC(C1CCCCC1)(NCCCCCO)CO
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C[C@@]1([C@H](N2CCCC2)CCCC1)O
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C1(CCCCC1)(CNCC1(CCCCC1)O)O
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N1CCCC1C(O)C(C)C
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C([C@H]1NC[C@@]2([H])[C@]1([H])C2)O
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CC(C(NC1C(O)CCCC1)(C)C)C
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CC(C(C1(NCCC1)C)O)(C)C
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CCCC1(C(O)C)NCCC1
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CC(C(N[C@H]1[C@H](O)CCCC1)(C)C)C
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C(C)(C)(CCCC(C)NCCO)O
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CC(CC(NC1CCCCCC1)CO)(C)C
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CCC1CCC(NC(CC(C)C)CO)CC1
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CCCCCCC(CN(CCO)CC)O
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CCCC1(NCCC1)CO
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CC(C(C1(NCCC1)C)O)C
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CCC(C1(NCCC1)C)O
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[C@H]1(CCCC[C@H]1O)NCCC
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C(O)(C1CCCN1)C(C)(C)C
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N1CCCC1C(CC)O
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CC(CC1(NCCC1)CO)C
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O[C@@H]1[C@@H](NC2CCCCC2)CCCC1
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CC(C(N[C@@H]1[C@@H](O)CCCC1)(C)C)C
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C(C)(CC)(O)C1CCCN1
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C1(O)(C2CCCN2)CC1
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CCC1(C(C(C)(C)C)O)NCCC1
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[C@]12([H])[C@]([H])(C1)CN[C@@H]2CO
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OC[C@@]1([C@@]2([H])C[C@@]2([H])CN1)[H]
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CCC1(C(C(C)C)O)NCCC1
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[C@@]12([C@@](CO)(NC[C@]1(C2)[H])[H])[H]
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[H][C@]12CN[C@H](CO)[C@@]1([H])C2
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CC1CCN(CC2(CCCC2)O)CC1
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CCC(C1(NCCC1)CC)O
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C(C)(O)(C(C)C)C1CCCN1
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CC[C@H]1CN(C(CO)(C)C)[C@H](C)CC1
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CC(CCC(CNCC(C)C)(O)C)C
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CC[C@H]1CN(C(CO)C)[C@H](C)CC1
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CC[C@H]1CN(C(C(O)C)C)[C@H](C)CC1
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CCCC(C1(CC(C)CNC1)O)C
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C[C@@]1([C@H](NCC2CC2)CCCC1)O
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CC1C(NC2C(O)(C)CCCC2)C1
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CCCCCCC(O)CN(CC)CCO
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CC1CCN(CC2(O)CCCC2)CC1
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CC(C)CC1(CO)CCCN1
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CCCN[C@@H]1CCCC[C@H]1O
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CCCC1(CO)CCCN1
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O[C@@H]1C[C@H]2CCC[C@@H]1N2
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O[C@H]1CC[C@@H]2CC[C@H]1N2
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Cl.OC12CCCCC1CCNC2
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OC1CC2CCCC1N2
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OC1CCC2CCC1N2
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O[C@@H]1CC[C@@H]2CC[C@H]1N2
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0.86 |
O[C@H]1C[C@H]2CCC[C@@H]1N2
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OCC[N+]12CCCCC1[C@H](CO)CCC2
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CN1CCCCC1C(O)CO
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OCC[N+]12CCCC[C@@H]1[C@H](CO)CCC2
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OC1CC2CCCCN2C1
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C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC[C@H]5C[C@@H](O)CC[C@]45C)[C@@H]3CC[C@H]1[C@]2(C)O
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CC1CCCC(CO)N1CCCN1CCCCC1
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CC(CCCC(C)(C)O)CCN1CCC(CC1)N(C)CCO
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Cl.OC1CC2CCC1NC2
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O[C@]1([C@]2(CC[C@](N2)(CC1)[H])[H])[H]
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OC1C2CCCC(N2)C1
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N12C[C@@H](C)CC[C@@]1([H])[C@@]([C@]1([H])CC[C@@]3([H])[C@]4([C@@]([H])([C@@]5(C)CC[C@@H](C[C@@]5(CC4)[H])O)C[C@@]3([H])[C@]1([H])C2)[H])(C)O
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[C@]12([H])N[C@]([H])([C@@H](O)C1)CCC2
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N1(CCC(C)CCCC(C)(C)O)CCC(CC1)N(C)CCO
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C12(C)CCC3(CC1(CO)NCC23C)[H]
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[C@]12([H])N[C@]([H])([C@H](O)C1)CCC2
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N1(CCC(CC1)N)CC1(O)CCC(CC1)C
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CC(C(CN1C(CCO)C(C)CCC1)O)O
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0.86 |
CC1N(CCCN2CCCCC2)C(CO)CCC1
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O[C@H]1[C@H]2N[C@H](CCC2)C1
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Cl.OC1CC2(CCCC2)CNC1
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O[C@@]1([C@@]2(CCC[C@@](N2)(C1)[H])[H])[H]
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O[C@H]1C[C@@H]2N[C@H]1CCC2
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C12CCC(CC1O)CN2.[H]Cl
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0.86 |
[N+]12(CCCC[C@]1([H])[C@@H](CCC2)CO)CCO
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OC1C2CCC(N2)CC1
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0.86 |
CC1(C(C2NCCCC2)(O)CC1N)C
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0.86 |
O[C@@]1([C@]2(CC[C@](N2)(CC1)[H])[H])[H]
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Cl.OCC1C2CC(CC2)N1
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O[C@]1([C@@]2(CCC[C@@](N2)(C1)[H])[H])[H]
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CC1(C(C2CCCCC2)O)NCCC1
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| MCULE-8605827730 |
0.86 |
OC1CC2(CCC2)NC1
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| MCULE-3437121077 |
0.86 |
OC1(C2CCC2)C2CCN(CC2)C1
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CC1(N(CCCCCF)CCCC1)CO
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| MCULE-4258704854 |
0.86 |
OC1(C2CCN(CC2)C1)CC1CC1
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0.86 |
OC(C1CCCCC1)CN1CC2C(CCC2)C1
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| MCULE-6536833107 |
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OC(C12NCC(C1)C2)CC1CCC1
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C12(CC3CC(CC(C3)C1)C2)C(O)CN1CCCC1.Cl
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|
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CN1C(C(CC2CCC2)O)CCC1
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| MCULE-9720387131 |
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OC(C1NCCC1)CC1CCC1
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CC1(CCC1)CC(C1NCCC1)O
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| MCULE-3206369814 |
0.86 |
CN1C(C(CC2(CCC2)C)O)CCC1
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CC1(C(CC2CCCC2)O)NCCC1
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| MCULE-8269598312 |
0.86 |
OC1(C2(CCCC2)CC1)CNC1CC1
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| MCULE-3394959891 |
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CN1C(C(C2CCCCC2)O)CCC1
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| MCULE-6258475872 |
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C[C@@]1([C@H](NC2(CC2)CO)CCCC1)O
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| MCULE-8776218849 |
0.86 |
CN1C(C(CC2CCCC2)O)CCC1
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| MCULE-6455274037 |
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CC1CC(CC2CC2)(O)CNC1
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| MCULE-9999065466 |
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CC1(CCC1)CC(C1(NCCC1)C)O
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|
| MCULE-1874167698 |
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OC(C1NC2C(CCCC2)C1)C1CC1
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|
| MCULE-3128542864 |
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CC1C(C2NCCC2)(O)CCCCC1
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| MCULE-3017830482 |
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O[C@H]1[C@@H]2[C@@H](CCN2)CC1
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| MCULE-3704715398 |
0.86 |
CC1(CN([C@H]2[C@@](O)(C)CCCC2)C1)O
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| MCULE-8043054502 |
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CC1(CN(C2C(O)(C)CCCC2)C1)O
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| MCULE-6568747386 |
0.86 |
CC1(C(NC2(CC2)CO)CCCC1)O
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| MCULE-7723722104 |
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N1(CCCCC1CO)CCCN
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| MCULE-6950364425 |
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CC1(C(C2CCCC2)O)NCCC1
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| MCULE-3520785842 |
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CC1CC(C2CCC2)(O)CNC1
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| MCULE-6737461855 |
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CN1C(C(C2CCCC2)O)CCC1
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| MCULE-9379641073 |
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CC(C1(CCC1)O)NCC1(CCCCC1)O
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| MCULE-5322741813 |
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OC1C(N2CC3C(C3)CC2)CCCC1
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| MCULE-6949299252 |
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CC1(C(CC2CCC2)O)NCCC1
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| MCULE-4999369759 |
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N1C(CCC)CC(O)C1C
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| MCULE-7676551647 |
0.86 |
[C@@]12(CCCN1)CCC[C@H]2O
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|
| MCULE-7572120269 |
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CC1(C(N2CC(O)C2)CCCC1)O
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| MCULE-6772886317 |
0.86 |
CC1(CCC1)CC(C12NCC(C1)C2)O
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|
| MCULE-9812867673 |
0.86 |
NC1CCC(NCC2(CCCCC2)O)CC1
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|
| MCULE-3288942021 |
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CCC1(C(C2CCCC2)O)NCCC1
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|
| MCULE-4289563507 |
0.86 |
C12(C)CCN(CCO)C1([H])CCC1C2CCC2(C1CCC2O)C
|
|
| MCULE-5345275241 |
0.86 |
N1(C)CC(CC1CCCC)O
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|
| MCULE-3949967779 |
0.86 |
N1(CC(C1)O)CC1(CCCCC1)O
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|
| MCULE-1580999934 |
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CCC(C1NC2C(CCCC2)C1)O
|
|
| MCULE-1344631198 |
0.86 |
O[C@H]1[C@H](N2CC3C(C3)CC2)CCCC1
|
|
| MCULE-3130783022 |
0.86 |
OC(C1NC(C2CC2)CC1)C1CCC1
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|
| MCULE-8137895589 |
0.86 |
CC(C1NC2C(CCCC2)C1)O
|
|
| MCULE-8450083307 |
0.86 |
CC(C(O)(C)C)NC1C(CCO)CCC1
|
|
| MCULE-7790238150 |
0.86 |
O[C@H]1[C@H]2[C@H](CCN2)CC1
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|
| MCULE-2695324681 |
0.86 |
CC1CN(C2(C(O)(C)CCC2)C)C1
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|
| MCULE-3446709778 |
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CC(C1(CCC1)O)NCC1(CCCCCC1)O
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|
| MCULE-6225614168 |
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N1(C)CC(CC1CCC)O
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|
| MCULE-2085547420 |
0.86 |
CC12CNC(C(CC3CCC3)O)(C1)C2
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|
| MCULE-9675143830 |
0.86 |
CC(C(C1NC2C(CCCC2)C1)O)C
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| MCULE-8382590731 |
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N1C(C)C(CC1CC(C)C)O
|
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| MCULE-4145887965 |
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CCC1(CCC(NC(C(O)(C)C)C)CC1)O
|
|
| MCULE-6492940069 |
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OCC1(NC2CC2)C2(CCCC2)CC1
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| MCULE-5131037262 |
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N1(C)CC(CC1CC(C)C)O
|
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| MCULE-8493497319 |
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CCCC(C1NC2C(CCCC2)C1)O
|
|
| MCULE-5337337614 |
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OC1(C2NCCC2)CCC2(CC2)CC1
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|
| MCULE-4348638877 |
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C[C@@]1([C@H](N2CC(O)C2)CCCC1)O
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| MCULE-1916405261 |
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C1(CC2(CCCNC2)O)CC1
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CCC1CN(C2(C(O)(C)CCC2)C)C1
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|
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OC1CC(C2CC2)NC1
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|
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CC1(CO)CCCCN1CCCCCF
|
|
| MolPort-037-962-809 |
0.86 |
OCC12CCC(CN1)C2
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|
| MolPort-002-155-154 |
0.86 |
Cl.OC(CN1CCCC1)C12CC3CC(CC(C3)C1)C2
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|
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NCCCN1CCCCC1CO
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|
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OC1CN(CC2(O)CCCCC2)C1
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OC(CN1CC2CCCC2C1)C1CCCCC1
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Cl.CCC(O)[C@H]1CCCN1
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CCCC1(CO)CCCN1C
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C[C@]12CCC3C(CC[C@H]4CC(O)CC[C@]34C)C1CCC2NCCO
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O[C@H]1CCCC[C@@H]1NCC1CC1
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O[C@H]1CCCC[C@@H]1NC1CCCC1
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Cl.OC[C@H]1NC[C@@H]2C[C@H]12
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CN(C1CCC1)[C@H]1CCCC[C@@H]1O
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Cl.CCC(O)[C@@H]1CCCN1
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CC(C)(C)C1CC(O)CN(C1)C(C)(C)C
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CC1(C)[C@H]2CN[C@H](CO)[C@@H]12
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Cl.OC[C@H]1NC[C@H]2C[C@@H]12
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OCC12CCCN1CCC2
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|
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CN(C1CCCCC1O)C1CCCCC1O
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CN(CCO)C1CCC2C3CC[C@H]4CC(O)CC[C@]4(C)C3CC[C@]12C
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|
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Cl.OC1(CC1)C1CCCN1
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O[C@@H]1CCCC[C@H]1NC1CC1
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OC1CCCCC1N1CCCC1
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O[C@H]1CCCC[C@@H]1N1CCCC1
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OCCNCC1(O)C2CC3CC(C2)CC1C3
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|
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OC1CCCCC1NC1CCC1
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|
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0.85 |
CC(C(N1[C@@H](C)CC[C@H](O)C1)C)C
|
|
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0.85 |
[C@]12(C)CCC(C[C@]1([H])CCC1C2CC[C@]2(C1CCC2NCCO)C)O
|
|
| MCULE-8838598233 |
0.85 |
CC(N([C@H]1[C@@](O)(C)CCCC1)C)CO
|
|
| MCULE-1796795404 |
0.85 |
CC(N(C1C(O)(C)CCCC1)C)CO
|
|
| MCULE-5732315243 |
0.85 |
CCC(C(N1[C@@H](C)CC[C@H](O)C1)C)C
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|
| MCULE-1011485677 |
0.85 |
CC1CC(CNC2C(O)CCCC2)C1
|
|
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0.85 |
O[C@@H]1[C@@H](NC2(C3CC3)CC2)CCCC1
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|
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0.85 |
CN([C@H]1[C@H](O)CCCC1)CC1(CC1)C
|
|
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0.85 |
CC(CN1[C@@H](C)CC[C@H](O)C1)C
|
|
| MCULE-4453970638 |
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CC1(C(C2CC2)O)NCCC1
|
|
| MCULE-8786352469 |
0.85 |
CCC(C(C1(NCCC1)C)O)C
|
|
| MCULE-5312880251 |
0.85 |
O[C@H]1[C@H](N2CC3(CC3)CCC2)CCC1
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|
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0.85 |
C12(CC3CC(CC(C3)C1)C2)C(O)CN(CCO)CCO
|
|
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0.85 |
CC1(C(CC2CC2)O)NCCC1
|
|
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0.85 |
O[C@H]1[C@H](NC2(C3CC3)CC2)CCCC1
|
|
| MCULE-3594936380 |
0.85 |
CC(N[C@H]1[C@@](O)(C)CCCC1)(CO)C
|
|
| MCULE-7689682711 |
0.85 |
N1(CCCC1)[C@@H]1CCCC[C@H]1O
|
|
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0.85 |
CCC(C1(CC(C)CNC1)O)CC
|
|
| MCULE-9292695859 |
0.85 |
N1(CC([H])(O)CC(C(C)(C)C)C1)C(C)(C)C
|
|
| MCULE-7615467748 |
0.85 |
CN([C@@H]1[C@@H](O)CCCC1)C1CCC1
|
|
| MCULE-4734510397 |
0.85 |
CC(NC1C(O)(C)CCCC1)(CO)C
|
|
| MCULE-6401816024 |
0.85 |
CC1CC(CN[C@H]2[C@H](O)CCCC2)C1
|
|
| MCULE-8641604681 |
0.85 |
C[C@H]1N(CCC(C)(C)C)C[C@H](O)CC1
|
|
| MCULE-4757425827 |
0.85 |
OC1(CCCC1)CNC1CCCCCC1
|
|
| MCULE-3160051344 |
0.85 |
CCC(N1[C@@H](C)CC[C@H](O)C1)C
|
|
| MCULE-1927901733 |
0.85 |
N(C1CCC1)C1CCCCC1O
|
|
| MCULE-2434325006 |
0.85 |
O[C@@H]1[C@@H](N2CC3(CC3)CCC2)CCC1
|
|
| MCULE-5353636198 |
0.85 |
CC(C(C(C1N(C)CCC1)O)C)C
|
|
| MCULE-8083699257 |
0.85 |
CC(C(C1(C2CCN(CC2)C1)O)C)C
|
|
| MCULE-1380959125 |
0.85 |
N1CCCC1C(O)CC(C)C
|
|
| MCULE-3141253581 |
0.85 |
CCCCN1[C@@H](C)CC[C@H](O)C1
|
|
| MCULE-9151862486 |
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CCC(C12NCC(C1)C2)O
|
|
| MCULE-3721912948 |
0.85 |
N1CCCC1C(CCC)O
|
|
| MCULE-5349297986 |
0.85 |
CC1CN([C@@H]2[C@@H](O)CCCC2)C1
|
|
| MCULE-5395228477 |
0.85 |
CCCC(C1(NCCC1)C)O
|
|
| MCULE-6142916673 |
0.85 |
CC(CCN1[C@@H](C)CC[C@H](O)C1)C
|
|
| MCULE-9634192824 |
0.85 |
CC1(C(NCCO)CCCC1)O
|
|
| MCULE-1051040062 |
0.85 |
CCCC1(C2CCN(CC2)C1)O
|
|
| MCULE-6418933804 |
0.85 |
CC1CN([C@H]2[C@H](O)CCCC2)C1
|
|
| MCULE-4509072822 |
0.85 |
C1(C(O)C2CCCN2)CC1
|
|
| MCULE-1120126713 |
0.85 |
C1CCCC(N(C)C2C(O)CCCC2)C1O
|
|
| MCULE-3407665239 |
0.85 |
CC(CC(NC1C2C3C(C(C2)C1)CCC3)CO)C
|
|
| MCULE-4931965271 |
0.85 |
CC1([C@H]2[C@@H]1CN[C@@H]2CO)C
|
|
| MCULE-4237199974 |
0.85 |
CC(CC(C1(NCCC1)C)O)C
|
|
| MCULE-5387670705 |
0.85 |
CCC1CN([C@H]2[C@H](O)CCCC2)C1
|
|
| MCULE-7577182625 |
0.85 |
OC1C(NCC2C3(CC3)C2)CCCC1
|
|
| MCULE-1598621018 |
0.85 |
CN([C@H]1[C@@](O)(C)CCCC1)CCO
|
|
| MCULE-3536723127 |
0.85 |
CN(C1C(O)CCCC1)CC1(CC1)C
|
|
| MCULE-2987404235 |
0.85 |
CCC1CN([C@@H]2[C@@H](O)CCCC2)C1
|
|
| MCULE-8735294564 |
0.85 |
CC(C(C1(CC(C)CNC1)O)C)C
|
|
| MCULE-8010423152 |
0.85 |
CC(NCC1(CCC(C(C)(C)C)CC1)O)C
|
|
| MCULE-2773194791 |
0.85 |
CC(N(C1(CCCCC1)CO)C)C
|
|
| MCULE-4782276967 |
0.85 |
CC1(NCC(O)CC1)C
|
|
| MCULE-4393514094 |
0.85 |
CCNC1C(O)(C)CCCC1
|
|
| MCULE-4473900513 |
0.85 |
CC(NC1C(O)(C)CCCC1)C
|
|
| MCULE-1965969511 |
0.85 |
CC1NCC(O)CC1
|
|
| MCULE-6848431518 |
0.85 |
CC(CCC(CNC1CCCC1)(O)C)C
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CC(C1CN(CC2(CCC(C)CC2)O)CCC1)O
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CCC(C1N(CC(CN2CCC(C)CC2)O)CCCC1)O
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C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)[C@H](C[C@]34C)N3CCCC3)[C@@H]1C[C@@H]([C@@H]2O)N1CCCC1
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CC12CNC(C(C3CCC3)O)(C1)C2
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CC(C(C(C12NCC(C1)(C)C2)O)C)C
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CC(C(C(C12NCC(C1)C2)O)C)C
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Cl.[C@@]12(CCCN1)CCC[C@H]2O
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O[C@H]1[C@H](N2CCC(F)CC2)CCCC1
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CC(C1(CCC1)O)NC1C2(CCC2)C(O)C1
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CC[C@@H](CN1C(C)CCC(CO)C1)O
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O[C@@H]1[C@@H](N2CCC(F)CC2)CCCC1
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N1(CCCCC1CO)C1CCN(CC1)C
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CC1CCC(CN2C(C(O)(C)C)CCC2)(O)CC1
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N1(CCCC)CC(CC1CC(C)C)O
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N1(CCC)CC(CC1CC(C)C)O
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OC1(C2NCCC2)C2(CCCC2)CC1
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Cl.O[C@H]1[C@H]2[C@H](CCN2)CC1
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N1(CC)CC(CC1CCC)O
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OC1CC(C2CCCCC2)NC1
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OC(C12NCC(C1)C2)C1CCCC1
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C1(CCCCC1)(CNCCCO)O
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CC(CC1(N(CC2CCNCC2)CCC1)CO)C
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O[C@H]1[C@@H]2[C@@H](CCN2)CC1.Cl
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CCCC1(N(CC2CCNCC2)CCC1)CO
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C12(C)CCC(C(O)C1NCC(C)(CC)O)C2(C)C
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OC1C(N2CCC(F)CC2)CCCC1
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C12(C)C(O)C(NCC(C)(CC)O)C(CC1)C2(C)C
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NCC1C(NCC2(CCCCC2)O)CCCC1
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OC(C1NCCC1)C1CC2C(C2)C1
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CC1CC(NCCCO)(CO)CC(C)(C)C1
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[C@]1(O)(C2CCC2)CCN(C[C@H]1C)CCO
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OC[C@@H]1N(CCCN2CCCCC2)CCCC1
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OC(C1NCCC1)CC1CC2C(C2)C1
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OC1CC2(CCCCCC2)NC1
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N1(CCCCC1CO)C1CCN(CC1)CCC
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OCC1(NC2CC2)CC2CC(CC2)C1
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CC[C@H](CNC1C(CO)CCCC1)O
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CC12CNC(C(C3CCCC3)O)(C1)C2
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OC(C1CC2C(C2)CC1)C1NCCC1
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N1C(CCCC)CC(O)C1C
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Cl.N1(CC([H])(O)CC(C(C)(C)C)C1)C(C)(C)C
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N1(CCCC1CO)C1C2CC3CC1CC(C3)C2
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N1(CCCC1CO)CC12CC3CC(CC(C3)C1)C2
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CC1C2(C(CO)NCC2)CCCCC1
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CC(CC(C12NCC(C1)C2)O)C
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C12(C)CCC3C(CCC4CCCCC34C)C1CCC2(CNCCO)O
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C[C@H]1N(CCC2CCC2)C[C@H](O)CC1
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N1(CCCC1CO)CC1CCCCC1
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N1(CCCC1CO)C1CCCCCC1
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CC1(C(CO)NCC1)CC1CCCC1
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N1(CCCC(O)C1)C1C2CC3CC1CC(C3)C2
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CCC(C(C12NCC(C1)C2)O)C
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CCCC(C12NCC(C1)C2)O
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OC(C12NCC(C1)C2)CC1CC1
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C[C@H]1N(C2CCCC2)C[C@H](O)CC1
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N1(CCCC(O)C1)C1CCC(CC1)C(C)(C)C
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OC(C12NCC(C1)C2)C1CCC1
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C12(C)CCC3C(CCC4CCCCC34C)C1CCC2(O)CN(CCO)CCO
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C[C@H]1N(CC2CC2)C[C@H](O)CC1
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OC(C12NCC(C1)C2)C1CC1
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C[C@H]1N(CC2CCC2)C[C@H](O)CC1
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C[C@H]1N(CCC2CC2)C[C@H](O)CC1
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N1(CCCC1CO)C1CCC(CC1)C
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O[C@H]1[C@H](NC23CCCC2C3)CCCC1
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C[C@H]1N(CC2(CCC2)C)C[C@H](O)CC1
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CCC1(C(C2CCC2)O)NCCC1
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C[C@H]1N(CC2CCCC2)C[C@H](O)CC1
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CC[C@@H](CN1[C@@H](C)CC[C@H](O)C1)O
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C[C@H](CN1[C@@H](C)CC[C@H](O)C1)O
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OCC1NCC2(CCC2)C1
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OCC1NCC2(CCCC2)C1
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OC1C(N2CC3CC(CC3)C2)CCC1
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C[C@@H](CN1[C@@H](C)CC[C@H](O)C1)O
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C[C@H]1N(CC(O)(C)C)C[C@H](O)CC1
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CC(C(N1[C@@H](C)CC[C@H](O)C1)C)O
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OC1C(N2CC3C(C3)CC2)CCC1
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OC1CN(CC2CCCCC2)CCC1
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OC1C(NCC2CC3C(C3)C2)CCC1
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OC1C(NCC23CCCC2C3)CCC1
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OCC1C2(CCC3(CC3)CC2)CCN1
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CCCC(C12NCC(C1)(C)C2)O
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OC1(C2CC2)C2CCN(CC2)C1
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OC1CC2(CC2)CNC1
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O[C@H]1[C@H](NC2CC3(CCC3)C2)CCC1
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N1(CC(C1)O)C1CCCCC1O
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OC1C(NC2CC3(CCC3)C2)CCC1
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CC[C@H](CN1[C@@H](C)CC[C@H](O)C1)O
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CC1(C(N2CC3C(C3)CC2)CCC1)O
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N1(CCCC(O)C1)C1CCCC(C)C1
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O[C@@H]1[C@@H](NC2CC3(CCC3)C2)CCC1
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OC1(C2CC2)CNCCC1
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N1(CCCC(O)C1)C1CCC(CC1)CC
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CC1(C(C2CCC2)O)NCCC1
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CC1CC(C2CC2)(O)CNC1
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OC1(CCCC1)CN1CC2C(C2)CC1
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CC12CNC(C(CC3CC3)O)(C1)C2
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OC1C(NC23CCCC2C3)CCCC1
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CC12CNC(C(C3CC3)O)(C1)C2
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C[C@H]1N(C2CCCCC2)C[C@H](O)CC1
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CC(CC(C12NCC(C1)(C)C2)O)C
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CCC(C(C12NCC(C1)(C)C2)O)C
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CC12CCC3C(CCC4CCCCC34C)C1CCC2(O)CN(CCO)CCO
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C[C@]12CCC3C(CC[C@H]4CCCC[C@]34C)C1CC[C@@]2(O)CNCCO
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C[C@]12CCC3C(CCC4CCCC[C@]34C)C1CC[C@@]2(O)CNCCO
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OC1CNCC2(CC2)C1
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OCC1CC2(CCCC2)CN1
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CC12CCC3C(CC[C@H]4CCCCC34C)C1CC[C@@]2(O)CNCCO
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CC1CCC(CC1)N1CCCC1CO
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CCC1CCC(CC1)N1CCCC(O)C1
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OC1CCCN(CC2CCCCC2)C1
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Cl.OCCNCC1(O)C2CC3CC(C2)CC1C3
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OCC1CCCN1C1C2CC3CC(C2)CC1C3
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OCC1CCCN1C1CCCCCC1
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OC1CN(C1)C1CCCCC1O
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OC1(CCCNC1)C1CC1
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CC1CCCC(C1)N1CCCC(O)C1
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OCC1CCCN1CC1CCCCC1
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[Cl-].OCC[NH2+]CC1(O)C2CC3CC(C2)CC1C3
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CC(C)(C)C1CCC(CC1)N1CCCC(O)C1
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CC12CCC3C(CCC4CCCCC34C)C1CCC2(O)CNCCO
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OC1CCCN(C1)C1C2CC3CC(C2)CC1C3
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Cl.CC(C)(C)C1CC(O)CN(C1)C(C)(C)C
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CCCN(CC1CC1)CC1(O)CCCC1
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Cl.C[C@@H]1CC[C@@H](O)CN1
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CC(CC1CCCCC1)NCC(O)C1CC1
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CC1CNC(C)(C)C(O)C1
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CC1CC(O)C(C)N(C)C1
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OC1(CNC2CCCC22CCC2)CCC1
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CCC(CO)N1CCCC2(CCN(C)CC2)C1
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CC(C)NCC1(O)CCC2C3CCC4CCCC[C@]4(C)C3CC[C@]12C
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CC1CC(O)C(C)(C)N(C)C1
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CCC1(O)CCCNC1
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CC1CC(C(C)(C)C)(O)CNC1
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C1(O)CC(C)CNC1(C)C
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CC(C1(C2CCN(CC2)C1)O)(C)C
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0.82 |
CCC(N1CC2C(C2)CC1)(C(O)C)C
|
|
| MCULE-7077421320 |
0.82 |
CC1CC2N(C(CO)(C)C)C(CC2)C1
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| MCULE-9598202458 |
0.82 |
CN(C1C(O)(C)CCC1)CC1(CC1)C
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| MCULE-9651068366 |
0.82 |
OC1(CCC1)CNC1C2(CCC2)CCC1
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| MCULE-4972342891 |
0.82 |
CC(C12NC(CC1)CC2)O
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| MCULE-2359766186 |
0.82 |
OC1(CCCNC1)CC
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| MCULE-9838034983 |
0.82 |
CCNCC1(CCC2(CC2)CC1)O
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| MCULE-2878174561 |
0.82 |
CC(NC1(C2(CCCC2)CC1)CO)C
|
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| MCULE-3315728220 |
0.82 |
CC1C(N([C@H]2[C@H](O)CCC2)C)CCC1
|
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| MCULE-4300635162 |
0.82 |
CC1C(N(C2C(O)CCC2)C)CCC1
|
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| MCULE-1500066373 |
0.82 |
CCNC1(CCC2(CC2)CC1)CO
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| MCULE-9694541966 |
0.82 |
C1(O)CC(C)CN(C)C1(C)C
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0.82 |
CC1(C(NCC2C3(CC3)C2)CCC1)O
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| MCULE-4321390061 |
0.82 |
CCNCC1(C2(CCCCC2)CC1)O
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| MCULE-1825102467 |
0.82 |
CCN1[C@@H](C)CC[C@H](O)C1
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0.82 |
CC(C1(CCC1)O)NC1C2(CCCC2)CC1
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| MCULE-6979028184 |
0.82 |
CC(NCC1(C2(CCCC2)CC1)O)C
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| MCULE-3074910945 |
0.82 |
C1(NCC(O)C2CCC2)CC1
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CCNC1(C2(CCCC2)CC1)CO
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0.82 |
CC(N1[C@@H](C)CC[C@H](O)C1)C
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| MCULE-6874456365 |
0.82 |
CCNCC1(C2(CCCC2)CC1)O
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| MCULE-4234046087 |
0.82 |
CCNC1(C2(CCCCC2)CC1)CO
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|
| MCULE-2207353105 |
0.82 |
C1(CC)(O)C2CCN(CC2)C1
|
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| MCULE-1161766631 |
0.82 |
O[C@@H]1CC[C@H](C)NC1.[H]Cl
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| MCULE-5674980700 |
0.82 |
C1(O)(C(C)C)C2CCN(CC2)C1
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| MCULE-3229982357 |
0.82 |
C12(C)CCC3C(CCC4CCCCC34C)C1CCC2(O)C[NH2+]C(C)C
|
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| MCULE-1640939229 |
0.82 |
CC(C(NC1C(O)(C)CCC1)(C)C)C
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| MCULE-2419699521 |
0.82 |
CC1(C(NC2(C3CC3)CC2)CCC1)O
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| MCULE-3946750130 |
0.82 |
Cl.C12(CC3CC(CC(C3)C1)C2)C(O)CN(CC)CC
|
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| MCULE-8922826910 |
0.82 |
Cl.CC1NCC(O)CC1
|
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| MCULE-6213174105 |
0.82 |
CCNC(C1(C2(CCCC2)CC1)O)C
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| MCULE-1646727489 |
0.82 |
N1[C@@H](C)CC[C@@H](O)C1.[H]Cl
|
|
| MCULE-2175540639 |
0.82 |
CC[C@@H](CN1C2CC(CC1CC2)C)O
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| MCULE-3357737091 |
0.82 |
C12(C)CCC3C(CCC4CC(O)CCC34C)C1CCC2(O)CNC(C)C
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| MCULE-1571552119 |
0.82 |
CCCN(CC1(CCCC1)O)CC1CC1
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| MCULE-2218980175 |
0.82 |
CC(NCC(C1CC1)O)CC1CCCCC1
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| MCULE-9165059461 |
0.82 |
CC(C1(CCC1)O)N[C@@H]1CC[C@@H](C)CC1
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| MCULE-4621949447 |
0.82 |
CCC1(CC(C)CNC1)O
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| MCULE-2623534291 |
0.82 |
CC(C1(CC(C)CNC1)O)C
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| MCULE-4776523477 |
0.82 |
OC(C1CC1)CN1CC2C(C2)CC1
|
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| MCULE-2376864577 |
0.82 |
CC(N1C2CC(CC1CC2)C)CO
|
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| MCULE-1902739569 |
0.82 |
Cl.C[C@H]1NC[C@@H](O)CC1
|
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| MCULE-4964169054 |
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Cl.CC1(NCC(O)CC1)C
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| MCULE-6941526141 |
0.82 |
CCC(CN1C2CC(CC1CC2)C)O
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| MCULE-6308240119 |
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Cl.N(C(CC)CO)CC1CCCCC1
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| MCULE-7189964586 |
0.82 |
CC(C(N1C2CC(CC1CC2)C)C)O
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|
| MCULE-9336363748 |
0.82 |
OC1C(NCC2C3(CC3)C2)CCC1
|
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| MCULE-8580027662 |
0.82 |
Cl.C[C@@]1(CC[C@@](O)(CN1)[H])[H]
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| MCULE-3988832358 |
0.82 |
O[C@H]1[C@H](NCC2C3(CC3)C2)CCC1
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| MCULE-9977815969 |
0.82 |
CCC(N1CC2(CCN(C)CC2)CCC1)CO
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| MCULE-4026878976 |
0.82 |
CC(NCC1(CCC2(CC2)CC1)O)C
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| MCULE-8578810557 |
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CC1(CCCCNC1)O
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| MCULE-5049261276 |
0.82 |
C[C@H]1N(C)C[C@H](O)CC1
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|
| MCULE-5606444759 |
0.82 |
OC1(CCCC1)CNCC1(CCCC1)O
|
|
| MCULE-8612888511 |
0.82 |
CCNC(C1(CCC2(CC2)CC1)O)C
|
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| MCULE-6338525816 |
0.82 |
C12(C)CCC(CC1CCC1C2CCC2(C1CC(C2)(O)CNC(C)C)C)O
|
|
| MCULE-4066203609 |
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CC(NC1(CCC2(CC2)CC1)CO)C
|
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| MCULE-9518716050 |
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CC(N1CCC(C2CCC2)CC1)CO
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|
| MCULE-8757518991 |
0.82 |
C(CO)(CO)(CO)N(CCCCCCCCC)CCCCCCCCC
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| MCULE-3756456945 |
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OCCN1C2C(CCCC2)CCC1
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| MCULE-8607299272 |
0.82 |
CC(N1CC2(CC2)CCC1)(CO)C
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|
| MCULE-2111956540 |
0.82 |
N1(CCO)CCC2C(CCCC2)C1
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|
| MCULE-5707132679 |
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CCCC(NCC1CCNCC1)(CO)C
|
|
| MCULE-3714334346 |
0.82 |
C(O)CCCC1CCCCN1
|
|
| MCULE-9527459698 |
0.82 |
CC(C(O)(C)C)NC1CC2(CCC2)C1
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|
| MCULE-8783515549 |
0.82 |
C[C@H]1[C@@H](O)CCCN1
|
|
| MCULE-6869468587 |
0.82 |
CC(C(CNC1C(C)(C)CCCC1)O)(C)C
|
|
| MCULE-2338043211 |
0.82 |
C(CO)(CO)(CO)N(CCCCCCC)CCCCCCC
|
|
| MCULE-3244268292 |
0.82 |
CCC(CN1CC2(CC2)CCC1)(O)C
|
|
| MCULE-1534622420 |
0.82 |
C1CC[C@@H]([C@H](C1)O)N(CC)CC
|
|
| MCULE-3502472037 |
0.82 |
CC(CN1CC(C2CCC2)CCC1)O
|
|
| MCULE-4670774259 |
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CC1C(O)CCCN1
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| MCULE-5252478732 |
0.82 |
C[C@@H](CN1CCC(C2CCC2)CC1)O
|
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| MCULE-5667779547 |
0.82 |
N(C(C)(C)C)[C@H]1CCCC[C@@H]1O
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|
| MCULE-9347350392 |
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CC(CN1CCC(C2CCC2)CC1)O
|
|
| MCULE-5401623917 |
0.82 |
CCCC(CNC1CCCC1)(CCC)O
|
|
| MCULE-8586400962 |
0.82 |
C[C@H](CN1CCC(C2CCC2)CC1)O
|
|
| MCULE-9918969973 |
0.82 |
CC(C(CN1CC2(CC2)CCC1)O)C
|
|
| MCULE-3165235462 |
0.82 |
CC(C(NC1CC2(CCC2)C1)C)O
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|
| MCULE-3364406141 |
0.82 |
CC(CC(C1CNCCC1)C)O
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|
| MCULE-2044057867 |
0.82 |
CC(NC1C(O)CCCC1)C
|
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| MCULE-8078189798 |
0.82 |
CCC(C(CNC1CCCCC1)(O)C)C
|
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| MCULE-3170952041 |
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CCC(C(CNC1CCCCC1)O)CC
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| MCULE-3979588660 |
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CC(N1CC2(CC2)CCC1)CO
|
|
| MCULE-2714466075 |
0.82 |
C[C@@H](CN1CC(C2CCC2)CCC1)O
|
|
| MCULE-5321498642 |
0.82 |
CCC(C(N1CC2(CC2)CCC1)C)O
|
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| MCULE-4394383137 |
0.82 |
N1CC(CC1C(C)(C)O)C
|
|
| MCULE-7684357711 |
0.82 |
N1CCCCC1CCCO
|
|
| MCULE-8675817972 |
0.82 |
CCC(CNC1[C@@H]2[C@@H](CCC2)CC1)(CC)O
|
|
| MCULE-4662005948 |
0.82 |
CC(CC1CNCCC1)(CO)C
|
|
| MCULE-5587440064 |
0.82 |
N1CCCC(CCCO)C1
|
|
| MCULE-9998369380 |
0.82 |
[C@H]1(CCCC[C@H]1O)NCC
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| MCULE-2597067770 |
0.82 |
CCC(CNC1CCCCCC1)(CC)O
|
|
| MCULE-7493635552 |
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OCCN1CC(C2CCC2)CCC1
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| MCULE-5238766757 |
0.82 |
O[C@H]1[C@@H](O)CC2(CCC2)NC1
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|
| MCULE-2749848918 |
0.82 |
N12CCCC3CC1CCC(O)C23
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|
| MolPort-006-192-123 |
0.82 |
CC(C)N[C@@H]1CCCC[C@H]1O
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|
| MolPort-016-631-172 |
0.82 |
CCN[C@@H]1CCCC[C@H]1O
|
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| MolPort-012-157-860 |
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OCCN1CCCC2CCCCC12
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| MolPort-013-041-046 |
0.82 |
CC(C)NC1CCCCC1O
|
|
| MolPort-044-188-311 |
0.82 |
CC(C)(C)N[C@H]1CCCC[C@@H]1O
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|
| MolPort-038-512-909 |
0.82 |
CCN(CC)[C@H]1CCCC[C@@H]1O
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| MolPort-046-691-672 |
0.82 |
OC1CCC(CC1)C(CC1CCCCN1)C1CCCCC1
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|
| MolPort-028-959-335 |
0.82 |
OCCCCC1CCCCN1
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|
| MolPort-001-485-461 |
0.82 |
CCCCCCCCCN(CCCCCCCCC)C(CO)(CO)CO
|
|
| MolPort-000-006-075 |
0.82 |
OCCCC1CCCCN1
|
|
| MolPort-000-006-076 |
0.82 |
OCCCC1CCCNC1
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|
| MolPort-001-485-459 |
0.82 |
CCCCCCCN(CCCCCCC)C(CO)(CO)CO
|
|
| MolPort-007-561-878 |
0.82 |
C[N+]12CCCCC1[C@@H](CCCO)CCC2
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|
| MolPort-020-394-594 |
0.81 |
OCCCCC1CCNCC1
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|
| MolPort-001-790-868 |
0.81 |
OCCN1CCC(CCCC2CCNCC2)CC1
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| MolPort-046-702-389 |
0.81 |
OCCN1CCC(CCC2CCN(CCO)CC2)CC1
|
|
| MolPort-003-179-080 |
0.81 |
CC(CO)N1CCCCC1C
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|
| MolPort-000-165-717 |
0.81 |
CCCCC(CCCC)C1CCN(CCO)CC1
|
|
| MolPort-004-285-327 |
0.81 |
OCCN1CCC(CCCC2CCN(CCO)CC2)CC1
|
|
| MolPort-000-165-715 |
0.81 |
CC(O)CN1CCCCC1C
|
|
| MolPort-015-091-556 |
0.81 |
CC1CCCC(C)N1CCO
|
|
| MolPort-012-113-800 |
0.81 |
CCC1CCCN(CCO)C1
|
|
| MolPort-002-496-536 |
0.81 |
CCCCCCCCCC1CCN(CCO)CC1
|
|
| MolPort-013-617-442 |
0.81 |
OC1CCCCC1NC1CCNCC1
|
|
| MolPort-046-420-249 |
0.81 |
Cl.O[C@@H]1CN[C@@H]2CCC[C@H]12
|
|
| MolPort-038-088-302 |
0.81 |
Cl.OC1CNC2(CCCC2)C1
|
|
| MolPort-046-148-628 |
0.81 |
Cl.CC12CNC(C1)C(O)CC2
|
|
| MolPort-028-308-123 |
0.81 |
CC1CC(C)(C)CC(CO)(C1)NCCCCC#N
|
|
| MolPort-046-419-888 |
0.81 |
Cl.OC1CNC2CCCCC12
|
|
| MolPort-013-616-277 |
0.81 |
CC(C)N1CCC(CC1)NC1CCCCC1O
|
|
| MolPort-028-283-862 |
0.81 |
CC(CO)(NCCCCC#N)C1CCCCC1
|
|
| MolPort-027-883-975 |
0.81 |
CCCC1(CO)CCCN(C1)C(CO)CO
|
|
| MolPort-039-066-271 |
0.81 |
CC(C)CCNC1CCN(CC1)C1CCCCC1O
|
|
| MolPort-044-203-123 |
0.81 |
OC[C@@H]1CCCN[C@@H]1CO
|
|
| MolPort-035-789-656 |
0.81 |
OC1C2CC3CNC1C3C2
|
|
| MCULE-6534227132 |
0.81 |
N1(CCO)C(C)CCCC1C
|
|
| MCULE-5375075266 |
0.81 |
CC(C1CN(CC(O)(C)C)CCC1)C
|
|
| MCULE-5130807894 |
0.81 |
C1C(C)N(CC(C)O)CCC1
|
|
| MCULE-2162486420 |
0.81 |
N(CCCCCCCCCCCC)(CCCCCCCCCCCC)CCO
|
|
| MCULE-6734789030 |
0.81 |
N(CC(CC)CC(CC)CCCC)(CCO)CC(CC)CC(CC)CCCC
|
|
| MCULE-5590066592 |
0.81 |
N(CCO)(CCCCCCC)CCCCCCC
|
|
| MCULE-8863364141 |
0.81 |
CCC1CN(CCO)CCC1
|
|
| MCULE-1887060610 |
0.81 |
N1(CCCCC1C)C(C)CO
|
|
| MCULE-9293787711 |
0.81 |
N(CCCCCCCC)CC(C)O
|
|
| MCULE-3244456645 |
0.81 |
C(CCCCCC)CCCCNCC(O)C
|
|
| MCULE-6277598372 |
0.81 |
C(CCCCCCCCC)N(CCCCCCCCCC)CCO
|
|
| MCULE-3623779879 |
0.81 |
N(CCCCCCCCCCCCCC)CC(C)O
|
|
| MCULE-2052025765 |
0.81 |
OCCN1CCC(CCCC2CCN(CCO)CC2)CC1
|
|
| MCULE-5184387420 |
0.81 |
C1CC(CCN1CCO)C(CCCC)CCCC
|
|
| MCULE-7999928874 |
0.81 |
N1(CCO)[C@@H](C)CCC[C@H]1C
|
|
| MCULE-2492519799 |
0.81 |
C(O)CCCC1CCNCC1
|
|
| MCULE-8591760422 |
0.81 |
CCCCCCCCN(CCCCCCCC)CCO
|
|
| MCULE-4520198133 |
0.81 |
N1(CCO)CCC(CCCC2CCNCC2)CC1
|
|
| MCULE-7139978545 |
0.81 |
N(CC(O)C)CCCCCCCCCCCCCCCC
|
|
| MCULE-2221607760 |
0.81 |
Cl.C12(C)CCC(C(O)C1NCC(C)(CC)O)C2(C)C
|
|
| MCULE-5504663546 |
0.81 |
CCCC1(NCC(O)C1)CO
|
|
| MCULE-3101491009 |
0.81 |
CC(CC1(NCC(O)C1)CO)C
|
|
| MCULE-2754218447 |
0.81 |
OCC1(C2CC2)NCC(O)C1
|
|
| MCULE-2653470313 |
0.81 |
OC1C2C3CC1CC3CN2
|
|
| MCULE-6691731436 |
0.81 |
CC(C1CCCCC1)(NCCCCC#N)CO
|
|
| MCULE-6723013885 |
0.81 |
N(C1CCNCC1)C1CCCCC1O
|
|
| MCULE-9373275178 |
0.81 |
Cl.C12(C)CCC(C(NCC(C)(CC)O)C1O)C2(C)C
|
|
| MCULE-3987022666 |
0.81 |
OC1C2NC(CC2)C(O)CC1
|
|
| MCULE-1676953824 |
0.81 |
OC1(CCCCC1)CNCC1CCC(C(F)(F)F)CC1
|
|
| MCULE-4983599891 |
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N1(CC(CC1CCC)O)CC1CC1
|
|
| MCULE-8527689003 |
0.81 |
CC1(C(N2CC(CO)C2)CCCC1)O
|
|
| MCULE-2913289498 |
0.81 |
CC1(C(NC2CC(O)C2)CCCC1)O
|
|
| MCULE-6465226580 |
0.81 |
C[C@@H](CN1C[C@@H]2[C@@H](CC[C@@H](C2)O)C1)O
|
|
| MCULE-8146732304 |
0.81 |
C[C@@]1([C@H](N2CC(CO)C2)CCCC1)O
|
|
| MCULE-5038227647 |
0.81 |
C[C@@]1([C@H](NC2CC(O)C2)CCCC1)O
|
|
| MCULE-5678243782 |
0.81 |
N1(CC(CC1CC(C)C)O)CC1CC1
|
|
| MCULE-5735087287 |
0.81 |
CC(CCNC1CCN(C2C(O)CCCC2)CC1)C
|
|
| MCULE-5344482747 |
0.81 |
NCC1C(NCC2(CCCCC2)O)CCC1
|
|
| MCULE-7542173279 |
0.81 |
OCCN1C[C@@H]2[C@@H](CC[C@@H](C2)O)C1
|
|
| MCULE-3731407388 |
0.81 |
C1(CCCCC1)(CNCCCN(C)C)O
|
|
| MCULE-7175544491 |
0.81 |
C[C@H](CN1C[C@@H]2[C@@H](CC[C@@H](C2)O)C1)O
|
|
| MCULE-9634975096 |
0.81 |
CC(N1CCC(NC2C(O)CCCC2)CC1)C
|
|
| MCULE-1711484283 |
0.81 |
CC1CC(NCCCCC#N)(CO)CC(C)(C)C1
|
|
| MCULE-5365746125 |
0.81 |
N1(CC(CC1CCCC)O)CC1CC1
|
|
| MCULE-3844695382 |
0.81 |
OC1(C2NCCC2)CC2CC(CC2)C1
|
|
| MCULE-8435365024 |
0.81 |
N1(CCCC(CCC)(CO)C1)C(CO)CO
|
|
| MCULE-3611337863 |
0.81 |
CC(N1C[C@@H]2[C@@H](CC[C@@H](C2)O)C1)CO
|
|
| MCULE-6608881492 |
0.81 |
CC(CC(NCCC(C)(C)C)CO)C
|
|
| MCULE-4858848815 |
0.81 |
Cl.N1(CCCC1CO)CC12CC3CC(CC(C3)C1)C2
|
|
| MCULE-3617131520 |
0.81 |
O[C@H]1[C@H](NC2CC3C(C3)CC2)CCC1
|
|
| MCULE-7317357321 |
0.81 |
CC(C(N1CC(CO)CCCC1)C)O
|
|
| MCULE-2457382099 |
0.81 |
N1(CCC(CC1)O)CC1(CCCC1)O
|
|
| MCULE-6724542480 |
0.81 |
OCC1CC(NC2C(O)CCCC2)C1
|
|
| MCULE-7149498316 |
0.81 |
OCC1C2(C3(CCCC3)CC2)CCN1
|
|
| MCULE-6143774490 |
0.81 |
OC1C(NC2CC3C(C3)CC2)CCC1
|
|
| MCULE-1765873209 |
0.81 |
C12(CC3CC(CC(C3)(O)C1)C2)C(C)NC(CO)CO
|
|
| MCULE-2065613793 |
0.81 |
O[C@H]1[C@H](NC2C3C(C3)CCC2)CCC1
|
|
| MCULE-3832359201 |
0.81 |
OC1C(N2CC3C(CC3)C2)CCCC1
|
|
| MCULE-8966136634 |
0.81 |
C[C@@H](CN1CC(CO)CCCC1)O
|
|
| MCULE-3808578117 |
0.81 |
O[C@H]1[C@H](N2CC3C(CC3)C2)CCCC1
|
|
| MCULE-6406967319 |
0.81 |
OC1(CCCC1)CN1CCC(F)CC1
|
|
| MCULE-8996003105 |
0.81 |
CC(N1CC(CO)CCCC1)CO
|
|
| MCULE-9026311814 |
0.81 |
CC(CN1CC(CO)CCCC1)O
|
|
| MCULE-6903204557 |
0.81 |
C1(CCCC1)(CO)CN(C)CC(CC)O
|
|
| MCULE-1141751490 |
0.81 |
OCC1C(C2CC3C(C3)C2)CCN1
|
|
| MCULE-5239363737 |
0.81 |
OCC1C(C2CC3C(C3)CC2)CCN1
|
|
| MCULE-6202506394 |
0.81 |
OCC1N(CC2CC3C(C3)C2)CCC1
|
|
| MCULE-3140070571 |
0.81 |
OCCN1CC(CO)CCCC1
|
|
| MCULE-6442058830 |
0.81 |
Cl.OCC1NCC2(CCC2)C1
|
|
| MCULE-9674878912 |
0.81 |
O[C@H]1[C@H](NC23CCCCC2C3)CCC1
|
|
| MCULE-1485103293 |
0.81 |
NC1CCN(CC(C2CCC2)O)CC1
|
|
| MCULE-2123890355 |
0.81 |
OC1C(NC23CCCCC2C3)CCC1
|
|
| MCULE-8649777892 |
0.81 |
CC(CN1CC(CO)CCCC1)(O)C
|
|
| MCULE-5769472368 |
0.81 |
N1(CCCC1CO)C1CC2CC1CC2
|
|
| MCULE-7009772542 |
0.81 |
OC[C@@H]1N([C@H]2[C@H](O)CCCC2)CCC1
|
|
| MCULE-1166710864 |
0.81 |
OC[C@@H]1N([C@@H]2[C@@H](O)CCCC2)CCC1
|
|
| MCULE-8344474721 |
0.81 |
OC[C@H]1N([C@H]2[C@H](O)CCCC2)CCC1
|
|
| MCULE-9154221914 |
0.81 |
OC[C@H]1N([C@@H]2[C@@H](O)CCCC2)CCC1
|
|
| MCULE-8723997794 |
0.81 |
CCC1(N(CC2CCNCC2)CCC1)CO
|
|
| MCULE-7372972185 |
0.81 |
C12(C)C(O)C(NCCO)C(CC1)C2(C)C
|
|
| MolPort-046-647-145 |
0.81 |
Cl.OC1CNCC2(CC2)C1
|
|
| MolPort-045-914-007 |
0.81 |
CCC(O)CN(C)CC1(CO)CCCC1
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|
| MolPort-026-751-787 |
0.81 |
OC1CCN(CC2(O)CCCC2)CC1
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| MolPort-016-617-853 |
0.81 |
CC(NC(CO)CO)C12CC3CC(CC(O)(C3)C1)C2
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|
| MolPort-045-968-245 |
0.81 |
OCC1CCCN1C1CC2CCC1C2
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| MolPort-002-121-995 |
0.81 |
Cl.OCC1CCCN1CC12CC3CC(CC(C3)C1)C2
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|
| MolPort-046-141-074 |
0.81 |
Cl.OCC1CC2(CCC2)CN1
|
|
| MCULE-3749506767 |
0.80 |
CCNC(C1(CC2CC(CC2)C1)O)C
|
|
| MCULE-2313618099 |
0.80 |
CC(N1[C@@H](C)CC[C@H](O)C1)CO
|
|
| MCULE-5480226153 |
0.80 |
[Cl-].C12(C)CCC3C(CCC4CCCCC34C)C1CCC2(O)C[NH2+]C(C)C
|
|
| MCULE-4560122506 |
0.80 |
CC(NCC1(CC2CC(CC2)C1)O)C
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|
| MCULE-6436563481 |
0.80 |
C12(C)CCC3C(CCC4CC(O)CCC34C)C1CCC2(O)CNC(C)C.Cl
|
|
| MCULE-4729923316 |
0.80 |
Cl.C12(C)CCC(CC1CCC1C2CCC2(C1CC(C2)(O)CNC(C)C)C)O
|
|
| MCULE-9807597195 |
0.80 |
CCNCC1(CC2CC(CC2)C1)O
|
|
| MCULE-9217963079 |
0.80 |
[H]Cl.CC1CNC(C)(C)C(C1)([H])O
|
|
| MCULE-9980293047 |
0.80 |
C[C@H]1N(CCO)C[C@H](O)CC1
|
|
| MCULE-8435728418 |
0.80 |
CC1(C(NC23CCCC2C3)CCC1)O
|
|
| MCULE-2812936453 |
0.80 |
CC1CC(CNC2C(O)(C)CCC2)C1
|
|
| MCULE-5756291079 |
0.80 |
Cl.OC1(CCCC1)CNCC1(CCCC1)O
|
|
| MCULE-3628370180 |
0.80 |
CC(NC1(CC2CC(CC2)C1)CO)C
|
|
| MCULE-4169078215 |
0.80 |
CCNC1(CC2CC(CC2)C1)CO
|
|
| MCULE-4405178782 |
0.80 |
OC1(CCCC1)CNC12CCCC1C2
|
|
| MCULE-2426742941 |
0.80 |
CC1CN(C2C(O)(C)CCC2)C1
|
|
| MCULE-8995195150 |
0.80 |
N(C)(C1CCCCC1)[C@@H]1CCC[C@H]1O
|
|
| MCULE-3444520213 |
0.80 |
Cl.CC(C12NC(CC1)CC2)O
|
|
| MCULE-4047083237 |
0.80 |
O[C@H]1[C@H](NC23CCCC2C3)CCC1
|
|
| MCULE-3392348906 |
0.80 |
[H]Cl.C1(O)CC(C)CN(C)C1(C)C
|
|
| MCULE-7098899436 |
0.80 |
OC1C(NC23CCCC2C3)CCC1
|
|
| MCULE-5172444040 |
0.80 |
CN1CC(CC(CO)N)CCC1
|
|
| MCULE-2729304424 |
0.80 |
OC(C1CC1)(C1CC1)CNC1[C@@H]2[C@@H](CCCC2)C1
|
|
| MCULE-8611389886 |
0.80 |
CC(C1(CCC1)O)NC1CC(C2CC2)CCC1
|
|
| MCULE-3442956887 |
0.80 |
Cl.CC1(CCCCNC1)O
|
|
| MCULE-8606493105 |
0.80 |
O[C@@H]1[C@@H](N2CC(CC3CC3)C2)CCC1
|
|
| MCULE-6441276149 |
0.80 |
OC(C1CC1)CN1CC2CC(CC2)C1
|
|
| MCULE-1307314357 |
0.80 |
C12(C)CCC3C(CCC4CCCCC34C)C1CCC2(O)CN1CC1
|
|
| MCULE-9096068296 |
0.80 |
OC1C(N2CC(CC3CC3)C2)CCC1
|
|
| MCULE-1279397544 |
0.80 |
O[C@H]1[C@H](N2CC(CC3CC3)C2)CCC1
|
|
| MCULE-1853295696 |
0.80 |
C12(C)CCC3C(CCC4CC(O)(CN5CC5)CCC34C)C1CCC2(O)CN1CC1
|
|
| MCULE-9944355641 |
0.80 |
OC1(C2CC2)CN(CCCC2CCCC2)C1
|
|
| MCULE-2178310862 |
0.80 |
CCC1CN(C2C(O)(C)CCC2)C1
|
|
| MCULE-9688599747 |
0.80 |
CC(N1C2CC3(CC1CC2)CC3)CO
|
|
| MCULE-6869487709 |
0.80 |
O[C@@H]1[C@@H](NC2(C3CCC3)CC2)CCC1
|
|
| MCULE-9949950539 |
0.80 |
N1(CCO)C(C)(C)CC(CC1(C)C)O
|
|
| MCULE-8650044331 |
0.80 |
O[C@H]1[C@H](NC2(C3CCC3)CC2)CCC1
|
|
| MCULE-4861665585 |
0.80 |
[C@]12(C)CCC3C(CCC4CCCC[C@]34C)C1CC[C@@]2(O)CN1CC1
|
|
| MCULE-4928681942 |
0.80 |
OCC1(NC2CC3(CCCCC3)C2)CC1
|
|
| MCULE-7773248186 |
0.80 |
OC1C(NC2(C3CCC3)CC2)CCC1
|
|
| MCULE-5941741029 |
0.80 |
N1(CC2(CCC2)O)CC2C(CCC2)C1
|
|
| MolPort-020-042-031 |
0.80 |
Cl.OC1(CNCC2(O)CCCC2)CCCC1
|
|
| MolPort-045-903-114 |
0.80 |
Cl.CC(C)NCC1(O)CC2C3CCC4CC(O)CCC4(C)C3CCC2(C)C1
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|
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0.80 |
OC1(CN(CCCC2CCCC2)C1)C1CC1
|
|
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0.80 |
Cl.CC(C)NCC1(O)CCC2C3CCC4CC(O)CCC4(C)C3CCC12C
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|
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0.80 |
C[C@]12CCC3C(CCC4CCCC[C@]34C)C1CC[C@@]2(O)CN1CC1
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|
| MolPort-009-757-448 |
0.80 |
Cl.CC(C)NCC1(O)CCC2C3CCC4CCCC[C@]4(C)C3CC[C@]12C
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Cl.OC1CCCCNC1
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|
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0.80 |
CN([C@@H]1CCC[C@H]1O)C1CCCCC1
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0.80 |
Cl.CC(O)C12CCC(CC1)N2
|
|
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0.80 |
Cl.CC1(O)CCCCNC1
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|
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0.80 |
[Cl-].CC(C)[NH2+]CC1(O)CCC2C3CCC4CCCCC4(C)C3CCC12C
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|
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0.80 |
CC1(C)CC(O)CC(C)(C)N1CCO
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|
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0.80 |
Cl.CC(C)C1(O)CCCNC1
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|
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0.80 |
OC1(CN2CC3CCCC3C2)CCC1
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|
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0.80 |
OCC1(CC1)NC1CC2(C1)CCCCC2
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0.79 |
Cl.O[C@@H]1CNC2(CCC2)C[C@@H]1O
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0.79 |
OC(CCCCCCCCC(O)=O)C[NH+]1CCCCC1
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0.79 |
OC1CCCCC1N1CCC2C(CCCN2C2CC2)C1
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|
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OC1CC2CCCC(C1)N2
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|
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0.79 |
OCC(CO)(CO)N(CC1CCCCC1)CC1CCCCC1
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|
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OC1CCC2CNCCC2C1
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|
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0.79 |
CC(O)CC1CCCCN1
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|
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0.79 |
[I-].C[N+]12CCCC[C@H]1[C@@H](CCCO)CCC2
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0.79 |
O[C@@H]1CCC[C@H]1N1CCCCC1
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CC(CO)C1CCCCN1
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0.79 |
CC(C)(CO)NC1(CO)CCCC1
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Cl.OCCCC1CCCCN1
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0.79 |
CC1CCN(CC1)[C@@H]1CCC[C@H]1O
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OCCC1CCCCN1
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0.79 |
OCC[C@@H]1CCCCN1
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Cl.CC1NCCCC1O
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OC1(CN2CCCCCC2)CCC1
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O[C@H]1C[C@@H]2CCC[C@H](C1)N2
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CC(O)[C@@H]1CCCN1C
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Cl.C[C@@H]1NCCC[C@@H]1O
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O[C@@H]1C[C@@H]2CCC[C@H](C1)N2
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C[C@@H]1CCC[C@H](CCO)N1
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OC1C[C@@H]2CCC[C@H](C1)N2
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CC1CCCC(CCO)N1
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OCC[C@H]1CCCCN1
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CCC1(CO)CCCN1C
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|
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0.79 |
O[C@]1(C[C@]2(CCC[C@](N2)(C1)[H])[H])[H]
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|
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0.79 |
CCC(CN1CC2CC(CC2)C1)(O)C
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0.79 |
O[C@@]1(C[C@]2(CCC[C@](N2)(C1)[H])[H])[H]
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CC(C(CN1CC2C(C2)CC1)O)(C)C
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N1(CCCCCC1)CC1(CCC1)O
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0.79 |
Cl.C[C@H]1[C@@H](O)CCCN1
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|
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0.79 |
O[C@@H]1[C@@H](NC2(C3CC3)CC2)CCC1
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|
| MCULE-1159412973 |
0.79 |
OCC[C@H]1CCCCN1
|
|
| MCULE-4868309425 |
0.79 |
CC(N1CC2CC(CC2)C1)(CO)C
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|
| MCULE-1641734460 |
0.79 |
CC(C(C1CNCCC1)(C)C)O
|
|
| MCULE-8175450243 |
0.79 |
CC(N1CC2C(C2)CC1)(CO)C
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|
| MCULE-5743173222 |
0.79 |
CC1CCN([C@H]2[C@H](O)CCC2)CC1
|
|
| MCULE-4753823032 |
0.79 |
Cl.C(O)CCC1CCCCN1
|
|
| MCULE-9548317654 |
0.79 |
CC(CCC1NCCCC1)O
|
|
| MCULE-8952289873 |
0.79 |
CC(N1CC2C(C2)CC1)CO
|
|
| MCULE-9405938695 |
0.79 |
CC[C@@H](CN1CC2C(C2)CC1)O
|
|
| MCULE-1687945599 |
0.79 |
N1CCCC[C@H]1CCO
|
|
| MCULE-6864631158 |
0.79 |
O[C@H]1[C@H](N2CCCCC2)CCC1
|
|
| MCULE-2387350394 |
0.79 |
CCC(CN1CC2C(C2)CC1)O
|
|
| MCULE-1552763402 |
0.79 |
CC(C1(CCC1)O)NCC1(C2CC2)CCC1
|
|
| MCULE-8739883227 |
0.79 |
CC(C(N1CC2C(C2)CC1)C)O
|
|
| MCULE-4176887053 |
0.79 |
O[C@H]1[C@H](NC2(C3CC3)CC2)CCC1
|
|
| MCULE-6032866383 |
0.79 |
OC[C@H]1NCC2(CC2)C1
|
|
| MCULE-4232350775 |
0.79 |
CC(C12NCC(C1)(C)C2)O
|
|
| MCULE-5526202911 |
0.79 |
N(C(C)(C)CO)C1(CCCC1)CO
|
|
| MCULE-9506439273 |
0.79 |
CCC(C(N1CC2CC(CC2)C1)C)O
|
|
| MCULE-2037430531 |
0.79 |
CC(C(CN1CC2C(C2)CC1)(O)C)C
|
|
| MCULE-9968852871 |
0.79 |
OC1C(NC2(C3CC3)CC2)CCC1
|
|
| MCULE-7315887021 |
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N12CCC(C(O)C1C)CC2
|
|
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N1CCCCC1CCO
|
|
| MCULE-4885335236 |
0.79 |
CC1(C(N2CC(O)CC2)CCCC1)O
|
|
| MCULE-6485564925 |
0.79 |
CC1CC(NCCCC#N)(CO)CC(C)(C)C1
|
|
| MCULE-8364225804 |
0.79 |
CC1(C(N2C[C@@H](O)CC2)CCCC1)O
|
|
| MCULE-3208152112 |
0.79 |
OC1C2(CCCC2)N(CCC2(CCC2)O)CC1
|
|
| MCULE-3540831445 |
0.79 |
CC(C#N)(CN1C(CO)CCCC1)C
|
|
| MCULE-7022962399 |
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C[C@@]1([C@H](N2C[C@@H](O)CC2)CCCC1)O
|
|
| MCULE-5160449750 |
0.79 |
C[C@@]1([C@H](N2C[C@H](O)CC2)CCCC1)O
|
|
| MCULE-3647650583 |
0.79 |
OC1CC(C2CC3C(C3)C2)NC1
|
|
| MCULE-4535008855 |
0.79 |
N1(CCC(O)C1)CC1(CCCCC1)O
|
|
| MCULE-1048832811 |
0.79 |
CC(CN(C1C(O)(C)CCCC1)C)N
|
|
| MCULE-5036351960 |
0.79 |
OC1CC(C2CC3C(C3)CC2)NC1
|
|
| MCULE-8656648819 |
0.79 |
NC1C2(CCC2)C(C2NCCC2)(O)C1
|
|
| MCULE-5744406376 |
0.79 |
CC1CC(C2(CCC2)CN)(O)CNC1
|
|
| MCULE-5070948464 |
0.79 |
CC(NCC1(CCCCC1)O)CC1NCCCCC1
|
|
| MCULE-2112343091 |
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OCC1(NC2CC2)CC(O)CCC1
|
|
| MCULE-2367434735 |
0.79 |
CC(CN([C@H]1[C@@](O)(C)CCCC1)C)N
|
|
| MCULE-8503343861 |
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CC(C1CCCCC1)(NCCCC#N)CO
|
|
| MCULE-6642031616 |
0.79 |
Cl.OC1C2NC(CC2)C(O)CC1
|
|
| MCULE-9893219423 |
0.79 |
CC(C1(CCCN1)[H])(O)C
|
|
| MCULE-1630762606 |
0.79 |
N(C(C)CC)C(C)CCCC(C)(C)O
|
|
| MCULE-3947440862 |
0.79 |
CC(C(NCC1CCNCC1)CO)(C)C
|
|
| MCULE-2512380120 |
0.79 |
CC(CN(C1C(C)CCCCC1)C)O
|
|
| MCULE-4206693506 |
0.79 |
CC(CN(C1CCC(C)CCC1)C)O
|
|
| MCULE-2051843667 |
0.79 |
CC(N(C1C(C)CCCCC1)C)CO
|
|
| MCULE-2882323395 |
0.79 |
N(C(C)CCCC(C)(C)O)CC(C)C
|
|
| MCULE-2018912206 |
0.79 |
N1C(C)(C)CC(CC1(C)C)CCO
|
|
| MCULE-9033257474 |
0.79 |
C[C@H](CNC1CC2(CCC2)C1)O
|
|
| MCULE-3608838385 |
0.79 |
C1(C(NCCC(C)CCCC(C)(C)O)C2CC2)CC1
|
|
| MCULE-7906115040 |
0.79 |
OC(C1C2(CCNCC2)C1)CC1CC1
|
|
| MCULE-8402876482 |
0.79 |
N(CCCCCCCC)(CC(C)O)CC(C)O
|
|
| MCULE-6450152667 |
0.79 |
N(CC(C)O)C1CCCC(C)C1
|
|
| MCULE-9267307894 |
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CC(C(NCC1CCCC1)(C)C)(O)C
|
|
| MCULE-4312911188 |
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N(CCCCCCCCCC)(CC(C)O)CC(C)O
|
|
| MCULE-3828606247 |
0.79 |
C[C@H](CN1CC2(CC2)CCC1)O
|
|
| MCULE-8194935959 |
0.79 |
C[C@@H](CN1CC2(CC2)CCC1)O
|
|
| MCULE-6071164444 |
0.79 |
C[C@@H](CN(C1C(C)CCCCC1)C)O
|
|
| MCULE-5657997414 |
0.79 |
CCC(NCC1CCNCC1)(CO)CC
|
|
| MCULE-1355156562 |
0.79 |
CC([C@H](NCC1CCNCC1)CO)(C)C
|
|
| MCULE-1176287657 |
0.79 |
C[C@@H](CN(C1CCC(C)CCC1)C)O
|
|
| MCULE-9089600697 |
0.79 |
C[C@@H](CN(C1CC(C)CC(C)C1)C)O
|
|
| MCULE-6859220464 |
0.79 |
N(CC(C)O)CC1CCCCC1
|
|
| MCULE-2322398169 |
0.79 |
OC(C1C2(CCNCC2)C1)C1CC1
|
|
| MCULE-1111493580 |
0.79 |
C(C1C2(CCNCC2)C1)CO
|
|
| MCULE-5887290105 |
0.79 |
CCC(C(C1C2(CCNCC2)C1)O)C
|
|
| MCULE-7247019275 |
0.79 |
N(CCCCCCCCCCCC)(CC(C)O)CC(C)O
|
|
| MCULE-4703580095 |
0.79 |
CC(C1N(CCCCCO)CCCC1)C
|
|
| MCULE-4028278024 |
0.79 |
C12(CC3CC(CC(C3)C1)C2)NCC(C)O
|
|
| MCULE-7046301237 |
0.79 |
CN1CCC(CC(CO)N)CC1
|
|
| MCULE-2209475466 |
0.79 |
CC(N(C1CCC(C)CCC1)C)CO
|
|
| MCULE-4227518627 |
0.79 |
CC1CCN(CC2(CCC2)O)CC1
|
|
| MCULE-5189354385 |
0.79 |
C1(C(C)NCCC(C)CCCC(C)(C)O)CC1
|
|
| MCULE-3305281853 |
0.79 |
OC1CCC2(CCNCC2)CC1
|
|
| MCULE-7020574826 |
0.79 |
N(CCCCCO)(CCO)CCC
|
|
| MCULE-3402364286 |
0.79 |
N1CCCC1C(C)O
|
|
| MCULE-7271465540 |
0.79 |