| MCULE-8965676491 |
0.81 |
CNC[C@H]1[C@H]2C=C[C@H](CC2)C1
|
|
| MCULE-7612238737 |
0.81 |
CN(CC1C2C=CC(CC2)C1)C
|
|
| MCULE-7826665580 |
0.80 |
C1(C)(CC2CC1C=C2)C[N+](C)(C)C
|
|
| MCULE-2501481360 |
0.80 |
C12(C)CCCC(C)(N)C1CC=C1C=C(C(C)C)CCC12
|
|
| MolPort-000-742-511 |
0.79 |
CNCC1C(C)CC(C)=CC1C
|
|
| MolPort-002-944-038 |
0.79 |
CC1CC(C)=CC(C)C1CN(C)C
|
|
| MolPort-002-560-863 |
0.79 |
CC1CC(C)=CC(C)C1C[N+](C)(C)C
|
|
| MCULE-7755497057 |
0.79 |
C1C(C)C(CNC)C(CC=1C)C
|
|
| MCULE-5388293696 |
0.79 |
C1(CN(C)C)C(C)CC(=CC1C)C
|
|
| MCULE-3596494094 |
0.78 |
C1(C)(CC2CC1C=C2)C[N+](C)(C)C.[I-]
|
|
| MolPort-009-767-177 |
0.78 |
[I-].CC1(C[N+](C)(C)C)CC2CC1C=C2
|
|
| MolPort-000-705-805 |
0.77 |
[I-].CC1CC(C)=CC(C)C1C[N+](C)(C)C
|
|
| MCULE-2429666619 |
0.76 |
CC(NC[C@H]1[C@H]2C=C[C@H](CC2)C1)C
|
|
| MCULE-7904269341 |
0.76 |
CC(NCC1C2C=CC(CC2)C1)(C)C
|
|
| MCULE-2219613129 |
0.76 |
CCNC[C@H]1[C@H]2C=C[C@H](CC2)C1
|
|
| MCULE-1705089270 |
0.76 |
CC(NCC1C2C=CC(CC2)C1)C
|
|
| MCULE-8011104748 |
0.76 |
CC(NC[C@H]1[C@H]2C=C[C@H](CC2)C1)(C)C
|
|
| MCULE-6416647346 |
0.76 |
CCNCC1C2C=CC(CC2)C1
|
|
| MolPort-011-249-025 |
0.74 |
CC(C)NCC1CC2CC1C=C2
|
|
| MolPort-002-550-929 |
0.74 |
CC1CC(C)=CC(C)C1CNC1CCCCC1
|
|
| MCULE-7860522622 |
0.74 |
C(C1CC=CCC1)NC1C2CC(CC2)C1
|
|
| MCULE-2522604628 |
0.74 |
C1=C(C)CC(C(CNC2CCCCC2)C1C)C
|
|
| MCULE-5952896973 |
0.74 |
CC(NCC1C2C=CC(C2)C1)C
|
|
| MCULE-8415118010 |
0.74 |
CNC(CC1C2C=CC(CC2)C1)C
|
|
| MCULE-4995838216 |
0.74 |
CNCCC1C2C=CC(CC2)C1
|
|
| MCULE-6643144793 |
0.74 |
C1(N(C)C)CCC=CCCC1
|
|
| MCULE-3854129268 |
0.74 |
[N+](C)(C)(C)C1CCCC=CCC1
|
|
| MCULE-1880935324 |
0.73 |
C([C@H]1[C@H]2C=C[C@H](CC2)C1)NC1CC1
|
|
| MCULE-8556029266 |
0.73 |
CN(CC1C2C=CC(C2)C1)CC1C2C=CC(C2)C1
|
|
| MCULE-9930853722 |
0.73 |
C1C2C3C=CC(C2CN1)CC3
|
|
| MCULE-1847393059 |
0.73 |
C1CC23CNCC2(CCCC3)CC=1
|
|
| MCULE-4481038186 |
0.73 |
C1CC23CN(C)CC2(CCCC3)CC=1
|
|
| MCULE-5632327052 |
0.73 |
CC1C(NCC2C3C=CC(CC3)C2)C1
|
|
| MCULE-2329507755 |
0.73 |
C(C1C2C=CC(CC2)C1)NC1CCC1
|
|
| MCULE-5202332149 |
0.73 |
CC1(NCC2C3C=CC(CC3)C2)CC1
|
|
| MCULE-9944420793 |
0.73 |
CC1C(NCC2C3C=CC(C3)C2)CCC1
|
|
| MCULE-2895855878 |
0.73 |
C(N1CCCC1)C1C2C=CC(CC2)C1
|
|
| MCULE-3947334491 |
0.73 |
C1CC(C2C3C=CC(CC3)C2)NC1
|
|
| MCULE-1783708995 |
0.73 |
C(C1C2C=CC(CC2)C1)NC1CC1
|
|
| MCULE-4705526502 |
0.73 |
[I-].[N+](C)(C)(C)C1CCCC=CCC1
|
|
| MolPort-029-924-865 |
0.73 |
CN(CC1CC2CC1C=C2)CC1CC2CC1C=C2
|
|
| MolPort-002-551-787 |
0.72 |
CC(C)CNCC1C(C)CC(C)=CC1C
|
|
| MolPort-005-992-247 |
0.72 |
CNCC1CCC=CC1
|
|
| MCULE-4774957045 |
0.72 |
C1C(C)C(CNCC(C)C)C(CC=1C)C
|
|
| MCULE-1193303005 |
0.72 |
CNC(CC1CC=CCC1)C
|
|
| MCULE-4261990794 |
0.72 |
CNC1CC(CC2CC=CCC2)CC1
|
|
| MCULE-7163673280 |
0.72 |
CNC1C(CC2CC=CCC2)CCC1
|
|
| MolPort-006-192-740 |
0.71 |
C1NCC2C3CC(C=C3)C12
|
|
| MolPort-044-729-626 |
0.71 |
C[C@]12CNC[C@H]1[C@@H]1C[C@H]2C=C1
|
|
| MolPort-005-984-495 |
0.71 |
C1NC[C@@H]2[C@H]3C[C@H](C=C3)[C@H]12
|
|
| MolPort-039-239-923 |
0.71 |
Cl.C1NCC2C1C1CCC2C=C1
|
|
| MCULE-7838668735 |
0.71 |
CN(C=O)CC1C2C=CC(CC2)C1
|
|
| MCULE-7665529614 |
0.71 |
O=CNCC1C2C=CC(CC2)C1
|
|
| MCULE-2907441290 |
0.71 |
N#CNCC1C2C=CC(CC2)C1
|
|
| MCULE-7199700638 |
0.71 |
[C@H]12C[C@H]([C@@]3([H])CNC[C@]31[H])C=C2
|
|
| MCULE-8376484020 |
0.71 |
C[C@@]12[C@@H]3C=C[C@@H](C3)[C@@H]1CNC2
|
|
| MCULE-7876781266 |
0.71 |
Cl.C1C2C3C=CC(C2CN1)CC3
|
|
| MCULE-9986856817 |
0.71 |
C12CC(C3([H])CNCC31[H])C=C2
|
|
| MCULE-4291397400 |
0.71 |
C(C1C2C=CC(C2)C1)NC(C1CC1)C1CC1
|
|
| MCULE-5137757743 |
0.71 |
CN(C#N)CC1C2C=CC(CC2)C1
|
|
| MCULE-5905854784 |
0.71 |
CC1C(C[N+]2(CCCCC2)C)C(C)C=C(C)C1
|
|
| MCULE-9590870909 |
0.71 |
C1CC2(CC=CCC2)CNC1
|
|
| MCULE-8927774364 |
0.71 |
C(C1CC=CCC1)NC12CCCC1C2
|
|
| MolPort-020-092-353 |
0.71 |
C1CNCC2(C1)CCC=CC2
|
|
| MolPort-002-538-686 |
0.71 |
CC1CC(C)=CC(C)C1CN1CCCCC1
|
|
| MolPort-001-950-790 |
0.71 |
CC1CC(C)=CC(C)C1C[N+]1(C)CCCCC1
|
|
| MolPort-004-163-373 |
0.70 |
CCN(CC)CCCC(C)NCC1CC2CC1C=C2
|
|
| MolPort-038-949-788 |
0.70 |
Cl.C1NCC2C3CC(C=C3)C12
|
|
| MolPort-039-060-777 |
0.70 |
Cl.C1NC[C@@H]2C3CC(C=C3)[C@H]12
|
|
| MCULE-2134110333 |
0.70 |
C(C1C2C=CC(CC2)C1)C1CNC1
|
|
| MCULE-2177807277 |
0.70 |
CNCC1(C2CCCCC2)CC=CC1
|
|
| MCULE-7863791614 |
0.70 |
CNCC1(C2CCCC2)CC=CC1
|
|
| MCULE-3962368741 |
0.70 |
CCN(CCCC(NCC1C2C=CC(C2)C1)C)CC
|
|
| MCULE-9149818462 |
0.70 |
C1C2C(C3C=CC2C3)CN1.Cl
|
|
| MolPort-000-744-361 |
0.69 |
[I-].CC1CC(C)=CC(C)C1C[N+]1(C)CCCCC1
|
|
| MCULE-9628861639 |
0.69 |
[I-].CC1C(C[N+]2(CCCCC2)C)C(C)C=C(C)C1
|
|
| MCULE-7130681547 |
0.69 |
C1C(NC2[C@@H]3[C@@H](C=CC3)C2)C2(CCCC2)C1
|
|
| MCULE-4664910549 |
0.69 |
C12CC(N(C)C)CCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
|
|
| MCULE-1089718746 |
0.69 |
N1C[C@@]2([H])CC=C(C)C[C@@]2([H])C1
|
|
| MCULE-1576778613 |
0.69 |
N1C[C@]2([C@]([H])(CC(=CC2)C)C1)[H]
|
|
| MCULE-7630841002 |
0.69 |
CNC1(C2C=CC(C2)C1)CN
|
|
| MCULE-8418790809 |
0.69 |
CN(C1(C2C=CC(C2)C1)CN)C
|
|
| MCULE-3562070975 |
0.69 |
CN1CCC(CNCC2C3C=CC(C3)C2)CC1
|
|
| MolPort-005-984-499 |
0.69 |
CC1=CC[C@H]2CNC[C@H]2C1
|
|
| MolPort-016-631-249 |
0.69 |
CC1=CC[C@@H]2CNC[C@@H]2C1
|
|
| MCULE-9053244213 |
0.68 |
NCC1C(NCC2CC=CCC2)CCCC1
|
|
| MCULE-7988894245 |
0.68 |
FC(C1CC(NCC2C3C=CC(C3)C2)CCC1)(F)F
|
|
| MolPort-045-906-329 |
0.67 |
CC(C1CCN(C[C@@H]2C[C@H]3C[C@@H]2C=C3)CC1)N1CCCC1
|
|
| MolPort-001-901-303 |
0.67 |
CN(C)CCCN(CCCN(C)C)CC1CC2CC1C=C2
|
|
| MCULE-5164317676 |
0.67 |
NCC1C2C=CC(CC2)C1
|
|
| MCULE-3916326115 |
0.67 |
NC[C@H]1[C@H]2C=C[C@H](CC2)C1
|
|
| MCULE-2095821097 |
0.67 |
NC1CCC(NCC2CC=CCC2)CC1
|
|
| MCULE-1686154842 |
0.67 |
CC(NC1[C@@H]2[C@@H](C=CC2)C1)CC(C)(C)C
|
|
| MCULE-6621316624 |
0.67 |
C12C3CCC(C=C3)C1CN(CCN)C2
|
|
| MCULE-2941758496 |
0.67 |
CN(CC1C2C=CC(CC2)C1)CC#N
|
|
| MCULE-1203403084 |
0.67 |
N#CCNCC1C2C=CC(CC2)C1
|
|
| MCULE-8863047338 |
0.67 |
C#CCNCC1C2C=CC(CC2)C1
|
|
| MCULE-5050515249 |
0.67 |
CN(CC(CNCC1C2C=CC(C2)C1)(C)C)C
|
|
| MCULE-5815586756 |
0.67 |
N1(CCCC1)C(C)C1CCN(CC1)C[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
| MCULE-8829081717 |
0.67 |
NC1CN(CC2C3C=CC(CC3)C2)C1
|
|
| MCULE-1004486541 |
0.67 |
CN(CC1C2C=CC(CC2)C1)CC#C
|
|
| MCULE-1624093788 |
0.67 |
C1(CC2CC1C=C2)CN(CCCN(C)C)CCCN(C)C
|
|
| MCULE-9154125304 |
0.67 |
CCN(CCCNCC1C2C=CC(C2)C1)CC
|
|
| MCULE-8240629504 |
0.67 |
C(C1C2C=CC(CC2)C1)C1NCCC1
|
|
| MCULE-5012665292 |
0.67 |
N1(CCN(CC1)CC1CC2CC1C=C2)C1CCC(CC1)C
|
|
| MCULE-2926458651 |
0.67 |
C(N1CCCCCC1)C1CC=CCC1
|
|
| MCULE-6347243005 |
0.67 |
C1C(C)C(CNCCCN(C)C)C(CC=1C)C
|
|
| MCULE-1977009649 |
0.67 |
N1(CCN(CC1)CC1CC2CC1C=C2)C1CCCCC1C
|
|
| MCULE-7186109921 |
0.67 |
CNCC1(C2CCC2)CC=CC1
|
|
| MCULE-1051804755 |
0.67 |
C(C1CC=CCC1)NC(C1CC1)C1CC1
|
|
| MCULE-8776833449 |
0.67 |
N1(CCN(CC1)CC1CC2CC1C=C2)C1CCCC(C)C1
|
|
| MCULE-5140075731 |
0.67 |
N1(CCN(CC1)CC1CC2CC1C=C2)C1CC2CC1CC2
|
|
| MCULE-7429324322 |
0.67 |
N1(C2CCCCC2)CCN(CC1)CC1CC2C=CC1C2
|
|
| MolPort-000-736-929 |
0.67 |
CC1CC(C)=CC(C)C1CNCCCN(C)C
|
|
| MolPort-002-771-836 |
0.67 |
CC1CCCCC1N1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-002-771-608 |
0.67 |
CC1CCC(CC1)N1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-001-987-836 |
0.67 |
C(C1CC2CC1C=C2)N1CCN(CC1)C1CC2CCC1C2
|
|
| MolPort-001-987-837 |
0.67 |
C(C1CC2CC1C=C2)N1CCN(CC1)C1CCCCC1
|
|
| MolPort-002-508-428 |
0.67 |
CC1CC2=C(CC1CNCCCN(C)C)C(C)(C)CCC2
|
|
| MolPort-035-705-658 |
0.67 |
C[C@H](NC(C)=O)[C@H]1CC[C@@]2(C)[C@@H]3C=C[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](N(C)C)C4(C)C
|
|
| MolPort-002-771-429 |
0.67 |
CC1CCCC(C1)N1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-011-249-445 |
0.66 |
CN1CCC(CC1)NCC1CC2CC1C=C2
|
|
| MolPort-002-149-037 |
0.66 |
C(C1CC2CC1C=C2)N1CCC(CC1)N1CCCCC1
|
|
| MolPort-044-233-001 |
0.66 |
CN(CCCO)C[C@@H]1C[C@H]2CC[C@@H]1C=C2
|
|
| MolPort-003-181-276 |
0.66 |
CN(CC1CC2CC1C=C2)C1CCN(C)CC1
|
|
| MolPort-002-149-985 |
0.66 |
CN(C)CCN(C)CC1CC2CC1C=C2
|
|
| MolPort-002-771-735 |
0.66 |
C(C1CCC=CC1)N1CCN(CC1)C1CC2CCC1C2
|
|
| MolPort-046-629-185 |
0.66 |
Cl.Cl.NCCN1CC2C(C1)C1CCC2C=C1
|
|
| MCULE-5886467262 |
0.66 |
N1(CCN(CC1)CC1CCC=CC1)C1CC2CC1CC2
|
|
| MCULE-9507245779 |
0.66 |
C(C1C2C=CC(CC2)C1)NC1CNC1
|
|
| MCULE-4912997888 |
0.66 |
CC(N1CCC(NCC2C3C=CC(C3)C2)CC1)(C)C
|
|
| MCULE-3988557550 |
0.66 |
CC(CN1CCCC1)CNCC1C2C=CC(C2)C1
|
|
| MCULE-1257963743 |
0.66 |
CC(N1CCC(NCC2C3C=CC(C3)C2)CC1)C
|
|
| MCULE-3123846578 |
0.66 |
C1(CC2CC1C=C2)CN(C)CCN(C)C
|
|
| MCULE-3198351569 |
0.66 |
C(CN1CCCC1)CNCC1C2C=CC(C2)C1
|
|
| MCULE-2357082088 |
0.66 |
CC1(NC(C)(C)CC(NCC2C3C=CC(C3)C2)C1)C
|
|
| MCULE-3081784410 |
0.66 |
NCCN1CC2C3C=CC(C2C1)CC3.Cl.Cl
|
|
| MCULE-5360666350 |
0.66 |
CN(C1CCCC1)CCNCC1C2C=CC(C2)C1
|
|
| MCULE-9414998548 |
0.66 |
CN(C(C)=O)CC1C2C=CC(CC2)C1
|
|
| MCULE-2224343678 |
0.66 |
N1(CCCCC1)C1CCN(CC1)CC1CC2CC1C=C2
|
|
| MCULE-4103542367 |
0.66 |
NCC1C(NCC2CC=CCC2)CCC1
|
|
| MCULE-4157689901 |
0.66 |
C(C1CC=CCC1)NCC1CC=CCC1
|
|
| MCULE-8864024625 |
0.66 |
C(C1C2C=CC(CC2)C1)C1CNCC1
|
|
| MCULE-2688790320 |
0.66 |
NC(C(F)F)CC1C2C=CC(CC2)C1
|
|
| MCULE-4595919995 |
0.66 |
Cl.NCC1C2C=CC(CC2)C1
|
|
| MCULE-8958038779 |
0.66 |
C1=C[C@@H]2C[C@H]1[C@@H](C2)CN
|
|
| MCULE-2991991523 |
0.66 |
C1=C[C@@H]2C[C@H]1[C@H](C2)CN
|
|
| MCULE-4489709878 |
0.66 |
C1=CC2CC1C(CN)C2
|
|
| MCULE-9404602553 |
0.66 |
NC[C@H]1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-9139433293 |
0.66 |
NC[C@H]1C2C=CC(C2)C1
|
|
| MCULE-5708370482 |
0.66 |
CC(N(CCNCC1C2C=CC(C2)C1)C)C
|
|
| MCULE-3512540675 |
0.66 |
CN(C[C@H]1[C@H]2C=C[C@H](CC2)C1)CCCO
|
|
| MCULE-3778966811 |
0.66 |
CCCCN1CCC(NCC2C3C=CC(C3)C2)CC1
|
|
| MCULE-5779960165 |
0.66 |
C1(CC2CC1C=C2)CN(C)C1CCN(CC1)C
|
|
| MCULE-6790112260 |
0.66 |
C(CN1CCCCC1)CNCC1C2C=CC(C2)C1
|
|
| MCULE-4446839208 |
0.66 |
CC(C#C)NCC1C2C=CC(CC2)C1
|
|
| MCULE-8537665467 |
0.66 |
CC(C#N)NCC1C2C=CC(CC2)C1
|
|
| MolPort-000-147-898 |
0.66 |
NCC1CC2CC1C=C2
|
|
| MolPort-029-998-232 |
0.66 |
NC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
| MolPort-039-242-278 |
0.66 |
Cl.NCC1CC2CCC1C=C2
|
|
| MolPort-023-231-685 |
0.66 |
NC[C@@H]1C[C@@H]2C[C@H]1C=C2
|
|
| MolPort-023-196-739 |
0.66 |
NC[C@@H]1CC2CC1C=C2
|
|
| MolPort-022-291-275 |
0.66 |
NCC1C[C@H]2C[C@@H]1C=C2
|
|
| MolPort-002-942-450 |
0.65 |
CC1CC(C)=CC(C)C1C[N+]1(CC=C)CCCCC1
|
|
| MolPort-020-053-780 |
0.65 |
N#CCCCCN1CCCC2(CCC=CC2)C1
|
|
| MolPort-000-701-749 |
0.65 |
CC1CC(C)=CC(C)C1CNCCO
|
|
| MolPort-002-549-906 |
0.65 |
CC1CC(C)=CC(C)C1CNCCNCC1C(C)CC(C)=CC1C
|
|
| MCULE-9903801290 |
0.65 |
C1C(C)C(CNCCO)C(CC=1C)C
|
|
| MCULE-9030382218 |
0.65 |
FC(C1CC(NCC2CC=CCC2)CCC1)(F)F
|
|
| MCULE-1363391204 |
0.65 |
CC(C1CC(C)=C(C)CC1)NC1CCN(C)CC1
|
|
| MCULE-2647258499 |
0.65 |
N#CCCCCN1CC2(CC=CCC2)CCC1
|
|
| MCULE-8653315178 |
0.65 |
C(C1CC=CCC1)NC1C(C2NCCC2)CCC1
|
|
| MCULE-3688524102 |
0.65 |
C1C(C)C(CNCCNCC2C(C)CC(=CC2C)C)C(CC=1C)C
|
|
| MCULE-6475158651 |
0.65 |
CC(C=C1CCC(N)CC1)CC(F)F
|
|
| MCULE-3469978911 |
0.65 |
CN(C(N)=O)CC1C2C=CC(CC2)C1
|
|
| MCULE-9307022422 |
0.65 |
C1(CC2CC1C=C2)CN(CCO)CCO
|
|
| MCULE-9164704101 |
0.65 |
C1(CC2CC1C=C2)CN1CCNCC1
|
|
| MCULE-7268224150 |
0.65 |
C1(CC2CC1C=C2)CN1CCN(CC1)CC1CC2CC1C=C2
|
|
| MCULE-3939633589 |
0.65 |
N1(CCCC1)C1CCN(CC1)CC1CC2C=CC1C2
|
|
| MCULE-3882145243 |
0.65 |
N1(C2CCCC2)CCN(CC1)CC1CC2C=CC1C2
|
|
| MCULE-4217554526 |
0.65 |
CCC(NCC1C2C=CC(C2)C1)CC#N
|
|
| MCULE-4427759024 |
0.65 |
CC1CCN(CCNCC2C3C=CC(C3)C2)CC1
|
|
| MCULE-1101121489 |
0.65 |
NC(NCC1C2C=CC(CC2)C1)=N
|
|
| MCULE-4436574111 |
0.65 |
OC1CN(CC2C3C=CC(CC3)C2)C1
|
|
| MCULE-6397149377 |
0.65 |
N1(C(CC)CC)CCN(CC1)CC1CC2CC1C=C2
|
|
| MCULE-5143091285 |
0.65 |
C(NCC1C2C=CC(C2)C1)CN1CCCCC1
|
|
| MCULE-3184575356 |
0.65 |
CN(C(CNCC1C2C=CC(C2)C1)(C)C)C
|
|
| MCULE-3619669769 |
0.65 |
N1(C(C)CC)CCN(CC1)CC1CC2C=CC1C2
|
|
| MCULE-3964157893 |
0.65 |
NC(NCC1C2C=CC(CC2)C1)=O
|
|
| MCULE-7283086614 |
0.65 |
C1(CC2CC1C=C2)CN1CCN(CC1)CC
|
|
| MCULE-6330203440 |
0.65 |
C1(CC2CC1C=C2)CN1CCN(CC1)C
|
|
| MCULE-1752592350 |
0.65 |
N1(CCCCCC1)C1CCN(CC1)CC1CC2CC1C=C2
|
|
| MCULE-2158294062 |
0.65 |
C1(CC2CC1C=C2)CN1CCN(CC1)CC1CCC=CC1
|
|
| MCULE-9640169860 |
0.65 |
C(C1C2C=CC(C2)C1)NC1CCN(C2CC2)CC1
|
|
| MCULE-8497517311 |
0.65 |
N1(C(C)C)CCN(CC1)CC1CC2CC1C=C2
|
|
| MCULE-1603768625 |
0.65 |
C1CC(CCC=1C)CN(CCCN(C)C)CC1CCC(=CC1)C
|
|
| MCULE-8808981826 |
0.65 |
CN1CCC(CCNC2[C@@H]3[C@@H](C=CC3)C2)CC1
|
|
| MCULE-1410208557 |
0.65 |
N1CC2C(CC=CC2)C1
|
|
| MCULE-7139023915 |
0.65 |
C(C1NCCCC1)C1CC=CCC1
|
|
| MCULE-8856314712 |
0.65 |
C1C[C@]2([H])CNC[C@]2([H])CC=1
|
|
| MCULE-7252772433 |
0.65 |
CC1(NCCC1)CC1CC=CCC1
|
|
| MCULE-2755546925 |
0.65 |
CC1(C(C2CCCCC=2)(F)CC1N)C
|
|
| MCULE-3838626432 |
0.65 |
CC1CC(CC2CC=CCC2)NCC1
|
|
| MCULE-5743384285 |
0.65 |
C(C1NCCCCC1)C1CC=CCC1
|
|
| MCULE-3953744763 |
0.65 |
C1CC2(CNCC2(C)CC=1)C
|
|
| MCULE-1830817807 |
0.65 |
C(C1CC=CCC1)C1NCCC1
|
|
| MCULE-3465367871 |
0.65 |
CCC1(NCCC1)CC1CC=CCC1
|
|
| MolPort-008-383-494 |
0.65 |
C(C1CC2CC1C=C2)N1CCNCC1
|
|
| MolPort-002-149-336 |
0.65 |
OCCN(CCO)CC1CC2CC1C=C2
|
|
| MolPort-002-149-680 |
0.65 |
CCN1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-001-997-420 |
0.65 |
CC(C)N1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-002-771-622 |
0.65 |
C(C1CC2CC1C=C2)N1CCC(CC1)N1CCCC1
|
|
| MolPort-001-997-419 |
0.65 |
C(C1CC2CC1C=C2)N1CCN(CC2CCC=CC2)CC1
|
|
| MolPort-001-997-418 |
0.65 |
C(C1CC2CC1C=C2)N1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-001-987-835 |
0.65 |
C(C1CC2CC1C=C2)N1CCN(CC1)C1CCCC1
|
|
| MolPort-001-987-834 |
0.65 |
CCC(C)N1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-002-575-433 |
0.65 |
C(C1CC2CC1C=C2)N1CCC(CC1)N1CCCCCC1
|
|
| MolPort-002-166-135 |
0.65 |
CN(C)CCCN(CC1CCC(C)=CC1)CC1CCC(C)=CC1
|
|
| MolPort-005-306-430 |
0.65 |
C1NC[C@@H]2CC=CC[C@H]12
|
|
| MolPort-006-192-739 |
0.65 |
C1NCC2CC=CCC12
|
|
| MolPort-003-179-091 |
0.64 |
NCC1C[C@H]2C=C[C@H]1C21CC1
|
|
| MCULE-4752008106 |
0.64 |
C12C(C)(C)CCCC=1CC(C)C(CNCCCN(C)C)C2 |
|
| MolPort-002-510-378 |
0.64 |
CC1CC2=C(CC1CN1CCN(C)CC1)C(C)(C)CCC2
|
|
| MolPort-002-158-772 |
0.64 |
CC1CC(CCC=C(C)C)=CCC1CNCCCN(C)C
|
|
| MolPort-002-771-244 |
0.64 |
CC1CCC(CC1)N1CCN(CC2CCC=CC2)CC1
|
|
| MolPort-044-605-337 |
0.64 |
CC(NCCCO)C1CCC(C)=C(C)C1
|
|
| MolPort-001-899-149 |
0.64 |
CC1CC(C)=CC(C)C1CN(C)C(C)=O
|
|
| MolPort-002-771-810 |
0.64 |
CC1CCCC(C1)N1CCN(CC2CCC=CC2)CC1
|
|
| MolPort-002-538-996 |
0.64 |
CC1CC(C)=CC(C)C1CN(CCO)CC1C(C)CC(C)=CC1C
|
|
| MolPort-002-771-565 |
0.64 |
CC1CCCCC1N1CCN(CC2CCC=CC2)CC1
|
|
| MCULE-4976412143 |
0.64 |
C1=CC2CC1C(C2)CN.Br
|
|
| MCULE-2924978391 |
0.64 |
Cl[H].C1=CC2CC1C(C2)CN
|
|
| MCULE-3786557678 |
0.64 |
OC1CCC(NCC2C3C=CC(C3)C2)CC1
|
|
| MCULE-6444541347 |
0.64 |
N1(CCN(CC1)CC1CCC=CC1)C1CCC(CC1)C
|
|
| MCULE-3111895588 |
0.64 |
C1(CN(CCO)CC2C(C)CC(=CC2C)C)C(C)CC(=CC1C)C
|
|
| MCULE-9255332793 |
0.64 |
C12C(C)(C)CCCC=1CC(C)C(CN1CCN(CC1)C)C2
|
|
| MCULE-1917976451 |
0.64 |
FC1(CCC(CNC2[C@@H]3[C@@H](C=CC3)C2)CC1)F
|
|
| MCULE-6905117546 |
0.64 |
C1(C(C)CC(=CC1C)C)CN(C)C(C)=O
|
|
| MCULE-5464908289 |
0.64 |
CC(C1CC(C)=C(C)CC1)NCCCO
|
|
| MCULE-2651690257 |
0.64 |
N1(CCN(CC1)CC1CCC=CC1)C1CCCCC1C
|
|
| MCULE-5919430966 |
0.64 |
C1(CC/C=C(/C)\C)CC(C)C(CC=1)CNCCCN(C)C
|
|
| MCULE-9305160554 |
0.64 |
N1(CCN(CC1)CC1CCC=CC1)C1CCCC(C)C1
|
|
| MCULE-9755970460 |
0.64 |
NC(C(F)F)CC1CC=CCC1
|
|
| MCULE-6473695758 |
0.64 |
CC(C(CC1CC=CCC1)N)(F)F
|
|
| MCULE-7937261563 |
0.64 |
NC(C(F)(F)F)CC1CC=CCC1
|
|
| MCULE-9569206103 |
0.64 |
CC(NCC1C2C=CC(C2)C1)CN1CCCCC1
|
|
| MCULE-8576481300 |
0.64 |
C1(CC2CC1C=C2)CN1CCC(CC1)O
|
|
| MCULE-4717912947 |
0.64 |
CNC1C(CC2CC=CC2)CCCC1
|
|
| MCULE-8690462543 |
0.64 |
CCN1CC(CNCC2C3C=CC(C3)C2)CC1
|
|
| MCULE-6224207903 |
0.64 |
CNC1C(CC2CC=CC2)CCC1
|
|
| MCULE-9827247513 |
0.64 |
CNC1C(C)C(CC2CC=CC2)CC1
|
|
| MCULE-1530971419 |
0.64 |
CCC(NCC1C2C=CC(CC2)C1)=O
|
|
| MCULE-7220238001 |
0.64 |
NC1CCC(=CC2CC3C(C3)C2)CC1
|
|
| MCULE-2887787188 |
0.64 |
CNC1CC(CC2CC=CC2)(C)CC1
|
|
| MCULE-1550829784 |
0.64 |
C1(CC2CC1C=C2)CN(CC(C)O)CC(C)O
|
|
| MCULE-2463724780 |
0.64 |
N1(C2CCCCCC2)CCN(CC1)CC1CC2C=CC1C2
|
|
| MCULE-7431755401 |
0.64 |
CN(CC(CO)(CO)C)CC1C2C=CC(C2)C1
|
|
| MCULE-9964180072 |
0.64 |
Cl.C1(CC2CC1C=C2)CN1CCN(CC1)C
|
|
| MCULE-8515037801 |
0.64 |
C1(CC2CC1C=C2)C(NC)=O
|
|
| MCULE-8175949984 |
0.64 |
C1(C)(CC2CC1C=C2)C(=O)N(C)C
|
|
| MCULE-3278877282 |
0.64 |
CNC1CC(CC2CC=CC2)CC1
|
|
| MCULE-6575293503 |
0.64 |
CNC1CC(CC2CC=CC2)CCC1
|
|
| MolPort-002-149-534 |
0.64 |
OC1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-035-845-246 |
0.64 |
CN(CC1CC2CC1C=C2)CC(C)(CO)CO
|
|
| MolPort-002-488-537 |
0.64 |
CNC(=O)C1CC2CC1C=C2
|
|
| MolPort-002-488-540 |
0.64 |
CN(C)C(=O)C1(C)CC2CC1C=C2
|
|
| MolPort-003-183-683 |
0.64 |
Cl.Cl.C(C1CC2CC1C=C2)N1CCNCC1
|
|
| MolPort-016-585-279 |
0.64 |
Cl.CN1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-002-771-467 |
0.64 |
C(C1CC2CC1C=C2)N1CCN(CC1)C1CCCCCC1
|
|
| MolPort-002-149-823 |
0.64 |
CC(O)CN(CC(C)O)CC1CC2CC1C=C2
|
|
| MolPort-006-003-697 |
0.63 |
CC1(C)CC(CC(C)(C)N1)NCC1CCC=CC1
|
|
| MolPort-035-945-097 |
0.63 |
Cl.C1NCC2CC=CCC12
|
|
| MolPort-044-722-622 |
0.63 |
C(C1CC2CC1C=C2)N1CCN2CCCC2C1C1CCCCC1
|
|
| MCULE-7300859188 |
0.63 |
CC(NCC1CC=CCC1)CC1NCCCCC1
|
|
| MCULE-9882299618 |
0.63 |
CC1(NC(C)(C)CC(NCC2CC=CCC2)C1)C
|
|
| MCULE-4333017063 |
0.63 |
CN(C=O)CC1CC=CCC1
|
|
| MCULE-1345741403 |
0.63 |
CN(C#N)CC1CC=CCC1
|
|
| MCULE-1892610210 |
0.63 |
[H]Cl.C1CC2(CNCC2(C)CC=1)C
|
|
| MCULE-6446418205 |
0.63 |
CCN(CCCC(NCC1CC=CCC1)C)CC
|
|
| MCULE-1127388659 |
0.63 |
Cl.N1CC2C(CC=CC2)C1
|
|
| MCULE-1871690408 |
0.63 |
Cl.N1C[C@H]2[C@H](CC=CC2)C1
|
|
| MCULE-7167657976 |
0.63 |
N1(CCN2C(CCC2)C1C1CCCCC1)CC1CC2CC1C=C2
|
|
| MCULE-7606577078 |
0.63 |
C1C(C)C(CNCCN2CCNCC2)C(CC=1C)C
|
|
| MCULE-3926734320 |
0.63 |
C1[C@@H]2[C@@H](CC=C2)C1NC1CCN(C2CCCCC2)CC1
|
|
| MCULE-8446789157 |
0.63 |
CCC(CC1C2C=CC(CC2)C1)N
|
|
| MCULE-7043656232 |
0.63 |
CC(CC1C2C=CC(CC2)C1)N
|
|
| MCULE-6074742583 |
0.63 |
NC(C1CCCC1)CC1CC=CCC1
|
|
| MCULE-6607195212 |
0.63 |
CC1C(CC2CC=CCC2)(N)CCC1
|
|
| MCULE-3381410416 |
0.63 |
CC(C(CC1C2C=CC(CC2)C1)N)C
|
|
| MCULE-1409643170 |
0.63 |
NC1(CCCCC1)CC1CC=CCC1
|
|
| MCULE-4639411185 |
0.63 |
CCC(CC1C2C=CC(CC2)C1)(N)C
|
|
| MCULE-2896000486 |
0.63 |
CC1CC(CC2CC=CCC2)(N)CC1
|
|
| MCULE-2662862659 |
0.63 |
CC(CC1C2C=CC(CC2)C1)(N)C
|
|
| MolPort-028-901-558 |
0.63 |
OC[C@H]1CC[C@@H](CC1)NCC1CCC=CC1
|
|
| MolPort-002-118-106 |
0.63 |
CC1CC(C)=CC(C)C1CNCCN1CCNCC1
|
|
| MolPort-002-537-790 |
0.63 |
CC(C12CC3CC(CC(C3)C1)C2)[N+](C)(C)C.CC(C)C1=CC2=CCC3C(C)(CCCC3(C)C([O-])=O)C2CC1
|
|
| MolPort-027-904-811 |
0.63 |
CC(CNCC1CC2CC1C=C2)N1CCN(C)CC1
|
|
| MolPort-004-955-852 |
0.62 |
C[C@H]1[C@H]2CC[C@H]3[C@@H]4CC=C5C[C@H](CC[C@]5(C)[C@H]4CC[C@]23CN1C)N(C)C
|
|
| MolPort-001-987-843 |
0.62 |
C(C1CCC=CC1)N1CCN(CC1)C1CCCCC1
|
|
| MCULE-2197273048 |
0.62 |
CC(C(N1CCN(C)CC1)CNCC1C2C=CC(C2)C1)C
|
|
| MCULE-1578175728 |
0.62 |
CC(NC1(C2C=CC(C2)C1)CN)C
|
|
| MCULE-4930838955 |
0.62 |
C(C1CNCCCC1)C1CC=CCC1
|
|
| MCULE-7951233042 |
0.62 |
CC#CCNCC1C2C=CC(CC2)C1
|
|
| MCULE-7520250001 |
0.62 |
C/C(/C)=C/CCC1(NCCCCC1)C
|
|
| MCULE-9712412071 |
0.62 |
CCN(C1(C2C=CC(C2)C1)CN)C
|
|
| MCULE-5244350796 |
0.62 |
C/C(/C)=C/CCC1NCCCCC1
|
|
| MCULE-1485114035 |
0.62 |
C(C1CC=CCC1)C1CNCCC1
|
|
| MCULE-2541248889 |
0.62 |
CCN1C(CNCC2C3C=CC(C3)C2)CCC1
|
|
| MCULE-4373107839 |
0.62 |
CC(C1CNCCC1)=CC1CCCC=1
|
|
| MCULE-8943557752 |
0.62 |
CC(N1CCN(C)CC1)CNCC1C2C=CC(C2)C1
|
|
| MCULE-2505591965 |
0.62 |
C(C1CN(C2CC2)CC1)NCC1C2C=CC(C2)C1
|
|
| MCULE-7905874468 |
0.62 |
CCNC1(C2C=CC(C2)C1)CN
|
|
| MCULE-5782650593 |
0.62 |
NCC1(CC=CCC1)CC(F)F
|
|
| MCULE-1508862693 |
0.62 |
CC(N(C1(C2C=CC(C2)C1)CN)C)C
|
|
| MCULE-4256908698 |
0.62 |
CCNC1C2C=CC(C2)C1
|
|
| MCULE-2931787181 |
0.62 |
[C@]123CC[C@]4([C@@]([H])(CC=C5C[C@@H](N(C)C)CC[C@]45C)[C@]1([H])CC[C@@H]2[C@@H](N(C)C3)C)[H]
|
|
| MCULE-3230025570 |
0.62 |
N1(C2CCCCC2)CCN(CC1)CC1CCC=CC1
|
|
| MCULE-5362309836 |
0.62 |
C123CCC4(C([H])(CC=C5CC(N(C)C)CCC45C)C1([H])CCC2C(N(C)C3)C)[H]
|
|
| MCULE-5241890848 |
0.62 |
CC(NC1[C@@H]2C=C[C@@H](C2)C1)C
|
|
| MCULE-4132189450 |
0.62 |
CN([C@@H]1CC[C@@]2(C(=CC[C@H]3[C@@H]4[C@]5(CN([C@H](C)[C@@H]5CC4)C)CC[C@@H]23)C1)C)C
|
|
| MCULE-7519404471 |
0.62 |
CNCC1(C2CC2)CC=CC1
|
|
| MCULE-8079117081 |
0.62 |
OC1C(NCC2C3C=CC(C3)C2)CCCC1
|
|
| MCULE-9076596037 |
0.62 |
CN1CCC(CNCC2CC=CCC2)CC1
|
|
| MCULE-8520289033 |
0.62 |
C1C2C1CC(NC1C3C=CC(C3)C1)C2
|
|
| MCULE-8341540910 |
0.62 |
CC1(CNCC1)CN1CC2(CC=CCC2)CCC1
|
|
| MCULE-7635311303 |
0.62 |
C1C2C1CC(NC1[C@@H]3C=C[C@@H](C3)C1)C2
|
|
| MCULE-9269423820 |
0.62 |
C1C2C1CC(C=C1CCNCCC1)C2
|
|
| MCULE-7771380815 |
0.62 |
NC1(CC=CCC1)CC1CC2C(C2)C1
|
|
| MCULE-9634831540 |
0.62 |
CN(C1CCCC1)CCNCC1CC=CCC1
|
|
| MCULE-9562404349 |
0.62 |
CC1N(CCCNCC2CC=CCC2)CCCC1
|
|
| MCULE-9035102748 |
0.62 |
C1C(C)(C)C(C=CC(=O)CCN)=C(C)CC1
|
|
| MolPort-046-067-756 |
0.62 |
O=CN[C@H]1C2CCC[C@H]1C1=C(CCCC1)C2
|
|
| MolPort-002-511-508 |
0.62 |
O.O=CN[C@H]1[C@@H]2CCC[C@H]1C1=C(CCCC1)C2
|
|
| MolPort-016-630-899 |
0.61 |
NCC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
| MolPort-002-771-634 |
0.61 |
C(C1CCC=CC1)N1CCN(CC1)C1CCCCCC1
|
|
| MolPort-035-945-915 |
0.61 |
O=C(NCC1CC2CC1C=C2)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-035-837-789 |
0.61 |
O=C(CC1CC2CCC1C2)N1CCCC2(CCC=CC2)C1
|
|
| MCULE-4947949077 |
0.61 |
CNC1(C#N)[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-9671632323 |
0.61 |
CNC(NCC1C2C=CC(CC2)C1)=N
|
|
| MCULE-9133284654 |
0.61 |
CNC1(C#N)C2C=CC(C2)C1
|
|
| MCULE-5551539861 |
0.61 |
CNC(NCC1C2C=CC(CC2)C1)=O
|
|
| MCULE-4873788872 |
0.61 |
CC(CC(NCC1C2C=CC(C2)C1)CO)C
|
|
| MCULE-8563079318 |
0.61 |
C(C1C2C=CC(C2)C1)NC1C=CCC1
|
|
| MCULE-4118922040 |
0.61 |
CC1CC(CCC2CCCCC=2)(N)C1
|
|
| MCULE-9139345212 |
0.61 |
NC1(CCC1)CCC1CCCCC=1
|
|
| MCULE-6946131615 |
0.61 |
C12C=CCCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC=2
|
|
| MCULE-6759509197 |
0.61 |
NC(C1CC1)CC1C2C=CC(CC2)C1
|
|
| MCULE-9658453042 |
0.61 |
NC1(CC1)CC1C2C=CC(CC2)C1
|
|
| MCULE-5238883105 |
0.61 |
NC1(CCC1)CC1C2C=CC(CC2)C1
|
|
| MCULE-1103598467 |
0.61 |
C1=C[C@@H]2C[C@H]1[C@@H](C2)CCN
|
|
| MCULE-1142010537 |
0.61 |
NC1CCC(=CCC2C(F)(F)C2)CC1
|
|
| MCULE-1812466037 |
0.61 |
C12CC(CC=C1CCN(C)C)C2(C)C
|
|
| MCULE-2887489947 |
0.61 |
NC1C2(CCC2)C(=CC2CCCC=2)C1
|
|
| MCULE-7884162803 |
0.61 |
CC1(C(CC2CC=CCC2)N)C(F)C1
|
|
| MCULE-2293780823 |
0.61 |
CCCNC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-4212437622 |
0.61 |
CCCNC1C2C=CC(C2)C1
|
|
| MCULE-8313982405 |
0.61 |
CCC(NC1[C@@H]2C=C[C@@H](C2)C1)C
|
|
| MCULE-9508008571 |
0.61 |
CC(C(NC1[C@@H]2C=C[C@@H](C2)C1)C)C
|
|
| MCULE-6307155081 |
0.61 |
CC1CC(NC2C3C=CC(C3)C2)CC1
|
|
| MCULE-3947202787 |
0.61 |
CC1C(NC2C3C=CC(C3)C2)CCC1
|
|
| MCULE-7429552546 |
0.61 |
CC(CNC1[C@@H]2C=C[C@@H](C2)C1)(C)C
|
|
| MCULE-4113675700 |
0.61 |
CC(CNC1C2C=CC(C2)C1)C
|
|
| MCULE-1601200812 |
0.61 |
C1[C@@H]2C=C[C@@H](C2)C1NC1CC=CCC1
|
|
| MCULE-6155848722 |
0.61 |
CC(C(C)(C)C)NC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-6039371894 |
0.61 |
CC(CNC1[C@@H]2C=C[C@@H](C2)C1)C
|
|
| MCULE-7062232609 |
0.61 |
C(C1CCCC1)NC1C2C=CC(C2)C1
|
|
| MCULE-6089738459 |
0.61 |
C1C2C=CC(C2)C1NC1CC=CCC1
|
|
| MCULE-1114749443 |
0.61 |
CC1CC(NC2[C@@H]3C=C[C@@H](C3)C2)CC1
|
|
| MCULE-2606325321 |
0.61 |
CC1C(NC2[C@@H]3C=C[C@@H](C3)C2)CCC1
|
|
| MCULE-2126510448 |
0.61 |
CCC(NC1C2C=CC(C2)C1)C
|
|
| MCULE-6246657854 |
0.61 |
C(C1CCCC1)NC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-7214307059 |
0.61 |
N1(C2CCCCCC2)CCN(CC1)CC1CCC=CC1
|
|
| MCULE-8589544345 |
0.61 |
CC(C(C)(C)C)NC1C2C=CC(C2)C1
|
|
| MCULE-9150734955 |
0.61 |
CC(CNC1C2C=CC(C2)C1)(C)C
|
|
| MCULE-3940287805 |
0.61 |
CC(C(NC1C2C=CC(C2)C1)C)C
|
|
| MCULE-2749337522 |
0.61 |
C12(CC3CC(CC(C3)C1)C2)C(=O)NCC1CC2CC1C=C2
|
|
| MCULE-9136781672 |
0.61 |
O=C(N1CC2(CC=CCC2)CCC1)CC1C2CC(CC2)C1
|
|
| MCULE-5491649123 |
0.61 |
CC1CC(C2(CC=CCC2)N)CCC1
|
|
| MCULE-8333591183 |
0.61 |
C12CCCCC=1CC1CCCC2C1N
|
|
| MCULE-2801706100 |
0.61 |
NC1(CC=CCC1)CC1CC=CCC1
|
|
| MCULE-7158288386 |
0.61 |
CC(CCC[C@H]([C@@H]1[C@]2(C)[C@H]([C@H]3[C@H](CC2)[C@]2(C)C(C[C@H](CC2)N)=CC3)CC1)C)C
|
|
| MCULE-7449944423 |
0.61 |
CC1CCC(C2(CC=CCC2)N)CC1
|
|
| MCULE-6279701935 |
0.61 |
CN(CC(CNCC1CC=CCC1)(C)C)C
|
|
| MCULE-5755276127 |
0.61 |
NC1(CC=CCC1)CC1CC(F)(F)C1
|
|
| MCULE-5565660016 |
0.61 |
CN(C1CC(N)C1)CC1CC=CCC1
|
|
| MCULE-8757056674 |
0.61 |
NC1(CC=CCC1)CCC1C(F)(F)C1
|
|
| MCULE-7814075185 |
0.61 |
CCN(CCCNCC1CC=CCC1)CC
|
|
| MCULE-8273639525 |
0.61 |
N1(CCN2C(CCC2)C1C1CCCCC1)CC1CCC=CC1
|
|
| MCULE-2966970292 |
0.61 |
CC(C=C1C(C)(C)C2C1CCCN2)=C
|
|
| MCULE-3362185232 |
0.61 |
CC(C(N1CC2(CC=CCC2)CCC1)=O)(C)C
|
|
| MCULE-2933665320 |
0.61 |
C12CC(CC1NC(=S)N)C1CC=CC21
|
|
| MolPort-019-707-116 |
0.61 |
NC1C2CCCC1C1=C(CCCC1)C2
|
|
| MolPort-002-894-514 |
0.61 |
NC(=S)NC1CC2CC1C1C=CCC21
|
|
| MolPort-042-725-389 |
0.61 |
CC(C)(C)C(=O)N1CCCC2(CCC=CC2)C1
|
|
| MolPort-003-182-879 |
0.61 |
C(C1CCC=CC1)N1CCN2CCCC2C1C1CCCCC1
|
|
| MolPort-001-987-842 |
0.60 |
C(C1CCC=CC1)N1CCN(CC1)C1CCCC1
|
|
| MolPort-003-993-534 |
0.60 |
OCCCCNCCC1CCCC=C1
|
|
| MolPort-032-516-801 |
0.60 |
C\C=C\CC1CCCNC1
|
|
| MolPort-044-195-960 |
0.60 |
CC=CCC1CCCNC1
|
|
| MolPort-027-904-854 |
0.60 |
OCCC(NCC1CC2CC1C=C2)C1CC1
|
|
| MolPort-027-904-850 |
0.60 |
OC1CCCC1NCC1CC2CC1C=C2
|
|
| MolPort-046-137-631 |
0.60 |
C=CC(=O)NCC1CC2CCC1C=C2
|
|
| MolPort-027-895-433 |
0.60 |
CC(C)N(CC1CC2CC1C=C2)CC(N)=O
|
|
| MolPort-002-115-103 |
0.60 |
NC(=O)C1CCN(CC2CC3CC2C=C3)CC1
|
|
| MolPort-030-179-934 |
0.60 |
OCC1CCCN(CC2CC3CC2C=C3)C1
|
|
| MolPort-009-758-253 |
0.60 |
[I-].CC(C)=CC1C(C[N+](C)(C)C)C1(C)C
|
|
| MCULE-4230196914 |
0.60 |
CC1(C=C2CCC(N)CC2)C(F)(F)C1
|
|
| MCULE-8152434532 |
0.60 |
C1CC(NC2[C@@H]3C=C[C@@H](C3)C2)C1
|
|
| MCULE-2627467250 |
0.60 |
CC(C1CC1)NC1C2C=CC(C2)C1
|
|
| MCULE-8907103450 |
0.60 |
CC1(CCC1)CNC1C2C=CC(C2)C1
|
|
| MCULE-8275104435 |
0.60 |
CC1C(C)C(NC2[C@@H]3C=C[C@@H](C3)C2)C1
|
|
| MCULE-6685463376 |
0.60 |
C(C1CCC1)NC1C2C=CC(C2)C1
|
|
| MCULE-2901033206 |
0.60 |
CC1C(NC2[C@@H]3C=C[C@@H](C3)C2)C1
|
|
| MCULE-2417237007 |
0.60 |
CC1(CC(NC2C3C=CC(C3)C2)C1)C
|
|
| MCULE-4799261489 |
0.60 |
CC(CNC1[C@@H]2[C@@H](C=CC2)C1)(CCO)C
|
|
| MCULE-6275026444 |
0.60 |
C(C1CC1)NC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-7699832917 |
0.60 |
CC1(C(NC2C3C=CC(C3)C2)C1)C
|
|
| MCULE-8102222832 |
0.60 |
C1C(NC2[C@@H]3C=C[C@@H](C3)C2)C1
|
|
| MCULE-1520344719 |
0.60 |
C(C1C2(CC2)C1)NC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-3731075171 |
0.60 |
C(N1CCC(NC2[C@@H]3[C@@H](C=CC3)C2)CC1)C1CC1
|
|
| MCULE-7512726538 |
0.60 |
CC(C1CCC1)NC1C2C=CC(C2)C1
|
|
| MCULE-8402599625 |
0.60 |
CC1(C(CNC2[C@@H]3C=C[C@@H](C3)C2)C1)C
|
|
| MCULE-3431041907 |
0.60 |
OC1(CCCCC1)CNCC1CC=CCC1
|
|
| MCULE-4512864157 |
0.60 |
CC(C1(CCCC1)O)(CNC1[C@@H]2[C@@H](C=CC2)C1)C
|
|
| MCULE-2401535208 |
0.60 |
C(CN1CCCC1)CNCC1CC=CCC1
|
|
| MCULE-3069492718 |
0.60 |
NC1CN(CC2CC=CCC2)C1
|
|
| MCULE-7982886353 |
0.60 |
C1CC(CCC=1)CN(C)CCN(C)C
|
|
| MCULE-5478666428 |
0.60 |
C1CC(CCC=1)CN(CC)CCN(C)C
|
|
| MCULE-4508873937 |
0.60 |
CC(CN1CC2C(CC=CC2)C1)(CCC#N)C
|
|
| MCULE-5985016985 |
0.60 |
C(CN1CCCCC1)CNCC1CC=CCC1
|
|
| MCULE-2457279453 |
0.60 |
C1CC(CCC=1)CN(C)CCN(CC)CC
|
|
| MCULE-5985174705 |
0.60 |
CCCCN1CCC(NCC2CC=CCC2)CC1
|
|
| MCULE-1452764739 |
0.60 |
CC(N(CCNCC1CC=CCC1)C)C
|
|
| MCULE-6291362078 |
0.60 |
CNC(C12CCCC1C2)C1CCCC=1
|
|
| MCULE-9181321467 |
0.60 |
CC1CCN(CCCNCC2CC=CCC2)CC1
|
|
| MCULE-4855041666 |
0.60 |
CC(N1CCC(NCC2CC=CCC2)CC1)C
|
|
| MCULE-2665225413 |
0.60 |
CC(CN1CCCCC1)CNCC1CC=CCC1
|
|
| MCULE-8534843996 |
0.60 |
CC(N(C(C)C)CCNCC1CC=CCC1)C
|
|
| MCULE-6963204306 |
0.60 |
CC(CN1CCCC1)CNCC1CC=CCC1
|
|
| MCULE-7649915621 |
0.60 |
CC(N1CCC(NCC2CC=CCC2)CC1)(C)C
|
|
| MCULE-5510401666 |
0.60 |
N(C)(CC1CCC=CC1)C1CCN(CC1)C
|
|
| MCULE-7896970171 |
0.60 |
CC1C(CC2CC=CCC2)CCC1N
|
|
| MCULE-9529373507 |
0.60 |
CC(C(CC1CC=CCC1)N)(C)C
|
|
| MCULE-5267150692 |
0.60 |
NCCCC1C2C=CC(CC2)C1
|
|
| MCULE-7746485475 |
0.60 |
CC(CCC1CCCCC=1)(N)C
|
|
| MCULE-1580510852 |
0.60 |
NC1C(CC2CC=CCC2)CCC1
|
|
| MCULE-2057188698 |
0.60 |
C/C(/C)=C/CCC1(C2CC(CC2)C1)N
|
|
| MCULE-7231960476 |
0.60 |
CC(CC1CC=CCC1)(N)C
|
|
| MCULE-8248292338 |
0.60 |
NCC1C(CC2CC=CCC2)CCC1
|
|
| MCULE-8362800496 |
0.60 |
CC(C(CC1C2C=CC(CC2)C1)C)N
|
|
| MCULE-1308903605 |
0.60 |
CC1(CC(N)CC1)CC1CC=CCC1
|
|
| MCULE-6548898843 |
0.60 |
NCC1(CCCC1)CC1CC=CCC1
|
|
| MCULE-3893886268 |
0.60 |
NC1C(CC2CC=CCC2)CCCC1
|
|
| MCULE-9913173386 |
0.60 |
CCC(CC1CC=CCC1)(N)C
|
|
| MCULE-7179237078 |
0.60 |
CC(C(CC1CC=CCC1)N)C
|
|
| MCULE-3199086814 |
0.60 |
CC(CC1C2C=CC(CC2)C1)(CN)C
|
|
| MCULE-6477004241 |
0.60 |
C/C(/C)=C/CCC1NCCCC1
|
|
| MCULE-6930411275 |
0.60 |
NCC1(C2C=CC(C2)C1)N
|
|
| MCULE-7795301532 |
0.60 |
CC1CC(CC/C=C(\C)/C)NCC1
|
|
| MCULE-7388428988 |
0.60 |
C/C(/C)=C/CCC1(NCCC1)C
|
|
| MCULE-5064019737 |
0.60 |
CNC(C12CCCC1C2)/C=C(\C)/C
|
|
| MCULE-3380955500 |
0.60 |
CC1NCCC(C2CCCCC=2)(F)C1
|
|
| MCULE-7714278100 |
0.60 |
C1C(C)(C)C(C=CC(=O)CCN)=C(C)CC1.I
|
|
| MCULE-5309855890 |
0.60 |
N1(C2CCCC2)CCN(CC1)CC1CCC=CC1
|
|
| MCULE-5029862705 |
0.60 |
OCCC(C1CC1)NCC1C2C=CC(C2)C1
|
|
| MCULE-7893508765 |
0.60 |
C=CC(NCC1C2C=CC(CC2)C1)=O
|
|
| MCULE-6059934101 |
0.60 |
O=C1CN(CC2C3C=CC(CC3)C2)CC1
|
|
| MCULE-7873645285 |
0.60 |
FC(C(NCC1C2C=CC(CC2)C1)=O)(F)F
|
|
| MCULE-1392709432 |
0.60 |
N1(CCCC(CO)C1)CC1CC2CC1C=C2
|
|
| MCULE-1828835388 |
0.60 |
NCC(NCC1C2C=CC(CC2)C1)=O
|
|
| MCULE-3188220453 |
0.60 |
C1(CC2CC1C=C2)CN1CCC(CC1)C(N)=O
|
|
| MCULE-1592164170 |
0.60 |
C(C1C2C=CC(CC2)C1)NC1COC1
|
|
| MCULE-7511125385 |
0.60 |
CC(N(CC(N)=O)CC1C2C=CC(C2)C1)C
|
|
| MCULE-3931607267 |
0.60 |
OC1C(NCC2C3C=CC(C3)C2)CCC1
|
|
| MCULE-8088989626 |
0.60 |
OC1CCC(NCC2CC=CCC2)CC1
|
|
| MCULE-6101970329 |
0.60 |
CC1C(NC2C3C=CC(C3)C2)CC1
|
|
| MCULE-8870550980 |
0.60 |
CC1(C(NC2[C@@H]3C=C[C@@H](C3)C2)CC1)C
|
|
| MCULE-5115086513 |
0.60 |
CC1(CCC1)CNC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-8597200984 |
0.60 |
CC1(C(CNC2C3C=CC(C3)C2)C1)C
|
|
| MCULE-4856677225 |
0.60 |
CC(C1CCC1)NC1[C@@H]2C=C[C@@H](C2)C1
|
|
| MCULE-3913488480 |
0.60 |
CC1CC(NC2C3C=CC(C3)C2)C1
|
|
| MCULE-7954284465 |
0.60 |
CC1(CC1)CNC1C2C=CC(C2)C1
|
|
| MCULE-2164902213 |
0.60 |
CC1C(CNC2C3C=CC(C3)C2)C1
|
|
| MCULE-1526455255 |
0.60 |
CC1CC(CNC2[C@@H]3C=C[C@@H](C3)C2)C1
|
|
| MCULE-7005238838 |
0.60 |
C(C1C2(CC2)C1)NC1C2C=CC(C2)C1
|
|
| MCULE-5335476563 |
0.60 |
CCC1C(NC2C3C=CC(C3)C2)C1
|
|
| MCULE-6647503088 |
0.60 |
C1CC(NC2C3C=CC(C3)C2)C1
|
|
| MCULE-3703130197 |
0.60 |
CC1(NCCC(=CC2CCCC=2)C1)C
|
|
| MCULE-1434742676 |
0.60 |
CCC1(C(NC2C3C=CC(C3)C2)C1)C
|
|
| MCULE-2098703101 |
0.60 |
CC1C(C)C(NC2C3C=CC(C3)C2)C1
|
|
| MCULE-5053871794 |
0.60 |
CC1C(NC2C3C=CC(C3)C2)C1
|
|
| MCULE-7144770159 |
0.60 |
CC1CC(CNC2C3C=CC(C3)C2)C1
|
|
| MCULE-5935165323 |
0.60 |
C(C1CC1)NC1C2C=CC(C2)C1
|
|
| MCULE-1666536703 |
0.60 |
C[C@@H](C=C[C@H]([C@@H]1[C@]2(C)C(=C3[C@@](CC2)([H])[C@]2(C)[C@@]4([C@H](CC2)C4)C=C3)CC1)C)C(C)C
|
|
| MCULE-1383026447 |
0.60 |
CC1NCCC(=CC2CCCC=2)C1
|
|
| MCULE-3057521267 |
0.60 |
CC1(C(NC2C3C=CC(C3)C2)CC1)C
|
|
| MCULE-5798906107 |
0.60 |
NC1CCC(=CC2C(F)(F)C2)CC1
|
|
