| MCULE-1731948266 |
0.95 |
C[C@H]1C(C)(C)[C@](C(C=C)=O)(C)CC1
|
|
| MCULE-5517605547 |
0.95 |
CC1C(C)(C)C(C(C=C)=O)(C)CC1
|
|
| MCULE-1331238833 |
0.95 |
CC1C(C)(C)C(C(C(C)=C)=O)(C)CC1
|
|
| MCULE-5001517452 |
0.95 |
C[C@H]1C(C)(C)[C@](C(C(C)=C)=O)(C)CC1
|
|
| MolPort-021-277-736 |
0.90 |
C=CCCC1CCC(=O)C1
|
|
| MolPort-028-600-701 |
0.90 |
CCCCCCC(=O)C=C
|
|
| MolPort-003-960-136 |
0.90 |
CCCCCC(=O)C=C
|
|
| MCULE-6260149584 |
0.87 |
C=CC([C@H]1C[C@@H]2[C@@H](C2)C1)=O
|
|
| MCULE-9648893158 |
0.87 |
C=CC(CC1CC2C(C2)CC1)=O
|
|
| MCULE-5311980903 |
0.87 |
C=CC(CC1CC2C(C2)C1)=O
|
|
| MCULE-8332698653 |
0.87 |
CC(C(C1CC2C(C2)CC1)=O)=C
|
|
| MCULE-8344260744 |
0.87 |
C=CC(C1C2C(C2)CCC1)=O
|
|
| MCULE-1172262319 |
0.87 |
CC(C([C@H]1C[C@@H]2[C@@H](C2)C1)=O)=C
|
|
| MCULE-5674842114 |
0.87 |
CC(C(C1C2C(C2)CCC1)=O)=C
|
|
| MCULE-6001167281 |
0.87 |
C=CC(C12CCCCC1C2)=O
|
|
| MCULE-9364716709 |
0.87 |
CC(C(C12CCCC1C2)=O)=C
|
|
| MCULE-9044416585 |
0.87 |
CC(C(C12CCCCC1C2)=O)=C
|
|
| MCULE-1085691571 |
0.87 |
C1C[C@]23C[C@@]42CC[C@]2(C)[C@@]([H])([C@@H](CCC(C)C(=C)C)C)CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@H](C)C1=O
|
|
| MCULE-4319644651 |
0.87 |
CC(C(CC1CC2C(C2)CC1)=O)=C
|
|
| MCULE-1123090644 |
0.87 |
CC(C(CC1CC2C(C2)C1)=O)=C
|
|
| MolPort-046-158-473 |
0.87 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CCC(=O)C4(C)C
|
|
| MolPort-039-141-869 |
0.87 |
C[C@H](CC[C@H](C)C(C)=C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@H](C)C(=O)CC[C@@]44C[C@@]34CC[C@]12C
|
|
| MolPort-039-338-310 |
0.87 |
C[C@H](CCC(C)C(C)=C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4[C@H](C)C(=O)CC[C@@]44C[C@@]34CC[C@]12C
|
|
| MolPort-021-277-693 |
0.86 |
C=CCC1CCC(=O)C1
|
|
| MolPort-013-677-784 |
0.86 |
C=CCC1CCCC1=O
|
|
| MolPort-022-366-208 |
0.86 |
C=CCC1(CCCC1)C=O
|
|
| MolPort-002-526-270 |
0.86 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12
|
|
| MolPort-000-697-885 |
0.86 |
CC(=C)C1CCC2(C)CCC3(C)C(CCC4C5(C)CCC(=O)C(C)(C)C5CCC34C)C12
|
|
| MolPort-027-835-586 |
0.86 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MCULE-8129046998 |
0.86 |
CC(C1C(C(C=C)=O)C1)(C)C
|
|
| MCULE-9528827676 |
0.86 |
CC1([C@@]2([H])[C@]([C@@]3([C@](CC2)(C)[C@]2([C@]([C@@]4([C@](CC2)(C)CC[C@H]4C(=C)C)[H])([H])CC3)C)[H])(C)CCC1=O)C
|
|
| MCULE-3196927861 |
0.86 |
CC(C(CC1C2CCC(CC2)C1)=O)=C
|
|
| MCULE-7132835769 |
0.86 |
O=C1CC[C@@]2(C)[C@H](C1(C)C)CC[C@]1(C)[C@@H]2CC[C@@H]2[C@H]3[C@H](C(=C)C)CC[C@]3(C)CC[C@@]12C
|
|
| MCULE-2335859358 |
0.86 |
CC(C(C=C)=O)C1CCC1
|
|
| MCULE-4058226083 |
0.86 |
C[C@H]1C(C)(C)[C@](C(CC=C)=O)(C)CC1
|
|
| MCULE-4841402169 |
0.86 |
C=CC(C1C(C2CC2)C1)=O
|
|
| MCULE-5296033788 |
0.86 |
C=CC(CC1C2CCC(CC2)C1)=O
|
|
| MCULE-1728954158 |
0.86 |
CC(C(C1C(C2CC2)C1)=O)=C
|
|
| MCULE-5586685403 |
0.86 |
C[C@H]1C(C)(C)[C@](C(CC(C)=C)=O)(C)CC1
|
|
| MCULE-5675527164 |
0.86 |
CC(C(C(C)=C)=O)C1CCC1
|
|
| MCULE-1271946970 |
0.86 |
CC(C(C1CC(C)(C)CC(C)(C)C1)=O)=C
|
|
| MCULE-4463857630 |
0.86 |
C12(C)CCC3(C(C(CC3)C(C)=C)C1CCC1C2(C)CCC2C1(C)CCC(=O)C2(C)C)C
|
|
| MCULE-5811572930 |
0.86 |
CC1C(C)(C)C(C(CC(C)=C)=O)(C)CC1
|
|
| MCULE-4608706769 |
0.86 |
CC(C(C1CC2(CCC2)C1)=O)=C
|
|
| MCULE-2745472455 |
0.86 |
C=CC(C1C2(CC2)C1)=O
|
|
| MCULE-9857037801 |
0.86 |
C1(=O)C(C(C)C)CCC(C)C1=C
|
|
| MCULE-2909585145 |
0.86 |
CC1C(C)(C)C(C(CC=C)=O)(C)CC1
|
|
| MCULE-7843810466 |
0.86 |
CC(C(C1C(C(C)(C)C)C1)=O)=C
|
|
| MCULE-5032910633 |
0.86 |
CC(C(C1C2(CC2)C1)=O)=C
|
|
| MCULE-5730123957 |
0.86 |
O=C(C)CCCCCCCCCC=C
|
|
| MolPort-021-070-499 |
0.86 |
CC(CCCC=C)C(C)=O
|
|
| MolPort-006-128-159 |
0.86 |
C=CCCCCCCC=O
|
|
| MolPort-006-128-160 |
0.86 |
C=CCCCCCCCC=O
|
|
| MolPort-001-784-299 |
0.86 |
C=CCCCCCCCCC=O
|
|
| MolPort-006-123-506 |
0.86 |
C=CCCCCCC=O
|
|
| MolPort-020-916-323 |
0.86 |
CC(=O)CCCCC=C
|
|
| MolPort-019-904-742 |
0.86 |
CC(=O)CCCCCC=C
|
|
| MCULE-1012434291 |
0.83 |
C=CC(C1CC2(CC2)CCC1)=O
|
|
| MCULE-2633944962 |
0.83 |
CC(C(C1CC2(CC2)CCC1)=O)=C
|
|
| MCULE-2977209967 |
0.83 |
C1(=C)C(C)(C)C2CC1(C=O)CC2
|
|
| MCULE-5889063907 |
0.83 |
C=CC(=O)C(C(=O)CCCC)CC
|
|
| MCULE-8469859649 |
0.83 |
C12C(C(=C)C)CCC1(C=O)CCC1(C)C3(C)CCC4C(C)(C)C(CCC4(C)C3CCC21)=O
|
|
| MCULE-4292909613 |
0.83 |
CC(C(C1CCC2(CC2)CC1)=O)=C
|
|
| MolPort-002-526-269 |
0.83 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C=O
|
|
| MolPort-004-969-579 |
0.83 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C=O
|
|
| MolPort-046-646-888 |
0.83 |
CC1(C)[C@@H]2C[C@H]1C(=C)C(=O)C2
|
|
| MCULE-4474599653 |
0.82 |
CC1CC(C(C(C)=C)=O)C1
|
|
| MCULE-4974026399 |
0.81 |
C=C(CCCC)C=O
|
|
| MolPort-009-198-593 |
0.81 |
C=CCCCCC=O
|
|
| MolPort-027-120-468 |
0.81 |
CC(C)CCC(=O)C=C
|
|
| MolPort-001-792-174 |
0.79 |
CC1(CC=C)C(=O)CCC1=O
|
|
| MCULE-3786446256 |
0.79 |
C=CCC([C@H]1C[C@@H]2[C@@H](C2)C1)=O
|
|
| MCULE-3557118862 |
0.79 |
CC(CC(C12CCCCC1C2)=O)=C
|
|
| MCULE-4566234355 |
0.79 |
C1(C)(CC=C)C(=O)CCC1=O
|
|
| MCULE-6092143192 |
0.79 |
C=CCC(C1C2C(C2)CCC1)=O
|
|
| MCULE-5596192032 |
0.79 |
CC(CC(C1C2C(C2)CCC1)=O)=C
|
|
| MCULE-8278725043 |
0.79 |
CC(CC(C1CC2C(C2)CC1)=O)=C
|
|
| MCULE-5818974588 |
0.79 |
C12(C(C)=O)CCC(C(=C)C1(C)C)C2
|
|
| MCULE-3940254776 |
0.79 |
C12(C=O)CCC(C(=C)C1(C)C)C2
|
|
| MCULE-7700350682 |
0.79 |
C12C(C(CC=C)CCC1C2)=O
|
|
| MCULE-4973461701 |
0.79 |
CC(CC(C12CCCC1C2)=O)=C
|
|
| MCULE-7113845835 |
0.79 |
CC(CC([C@H]1C[C@@H]2[C@@H](C2)C1)=O)=C
|
|
| MolPort-001-781-439 |
0.78 |
C=CCC1CCCCC1=O
|
|
| MolPort-039-337-244 |
0.78 |
C=CC1CCCC(=O)C1
|
|
| MolPort-046-736-469 |
0.78 |
CC12CC(=C)CC(C)(CC(=O)C1)C2
|
|
| MolPort-005-909-364 |
0.78 |
C[C@H]1CC[C@@H](CC1=O)C(C)=C
|
|
| MolPort-006-125-896 |
0.78 |
C[C@@H]1CC[C@@H](C(C)=C)C(=O)C1
|
|
| MolPort-019-955-419 |
0.78 |
C=CCC1(CCCCC1)C=O
|
|
| MolPort-000-142-101 |
0.78 |
C=C1CC2CC(C1)CC(=O)C2
|
|
| MCULE-5145799255 |
0.78 |
C=CCC(C1C2(CC2)C1)=O
|
|
| MCULE-5192402567 |
0.78 |
C1CCC(CC=C)C(=O)C1
|
|
| MCULE-4962666890 |
0.78 |
C1C(=O)CC(C=C)CC1
|
|
| MCULE-9759260142 |
0.78 |
CC1(CC(C=O)(CC=C)CC(C)(C)C1)C
|
|
| MCULE-3190275628 |
0.78 |
C1(=O)C(C)CCC(C(C)=C)C1
|
|
| MCULE-4399793543 |
0.78 |
CC(CC(C1C2(CC2)C1)=O)=C
|
|
| MCULE-7342356938 |
0.78 |
C1([C@@H](C)CC[C@H](C(C)=C)C1)=O
|
|
| MCULE-5476535126 |
0.78 |
C1(=C)CC2CC(CC(=O)C2)C1
|
|
| MCULE-2917163775 |
0.78 |
CC1(CC(C)(C)CC(C(CC=C)=O)C1)C
|
|
| MCULE-7185140311 |
0.78 |
CC(CC(C1CC2(CCC2)C1)=O)=C
|
|
| MolPort-002-489-358 |
0.77 |
CCCCC(=O)CC=C
|
|
| MolPort-023-400-624 |
0.77 |
C=CC(=O)CC1CC1
|
|
| MCULE-5695617305 |
0.77 |
CC1CC(C(C=C)=O)C1
|
|
| MCULE-8934357587 |
0.77 |
O=C1C(C)(C)C2(CCC3(C)C4(C)CCC5(C)CCC(C(C)C)C5(C4(CCC3C2(C)CC1=CO)[H])[H])[H]
|
|
| MCULE-9126879875 |
0.77 |
O=C1C(C)(C)C2(CCC3C4CCCC4(C)CCC3C2(C)CC1=CO)[H]
|
|
| MCULE-8136328597 |
0.76 |
C1C(=O)C(=CO)CCCCC1
|
|
| MCULE-2589305143 |
0.76 |
CC1C(=O)CCC1CC/C=C(\C)/C
|
|
| MCULE-1810658219 |
0.76 |
C/C(/C)=C/CCC1(CC(=O)CC1)C
|
|
| MCULE-2838707070 |
0.75 |
CC(CC(C1CCC2(CC2)CC1)=O)=C
|
|
| MCULE-1591010125 |
0.75 |
C=CCC(C1CC2(CC2)CCC1)=O
|
|
| MCULE-2320480898 |
0.75 |
CC(CC(C1CC2(CC2)CCC1)=O)=C
|
|
| MCULE-2389755893 |
0.74 |
[H]C12CCCCC1(C)C1CCC3(C)C(C(=CO)CC3C1CC2)=O
|
|
| MCULE-9440799330 |
0.74 |
CC1CC(C(CC=C)=O)C1
|
|
| MCULE-7144486441 |
0.74 |
CC1CC(C(CC(C)=C)=O)C1
|
|
| MCULE-4157028706 |
0.73 |
O=C1C(CC2CC=CC2)CCCCC1
|
|
| MCULE-8089081418 |
0.73 |
CC1(CC(=O)CC1)CC1CC=CC1
|
|
| MCULE-8182062032 |
0.73 |
C1(=CO)C(C)CCC(C(C)C)C1=O
|
|
| MCULE-6683714278 |
0.73 |
O=CC1(CCCCCC1)CC1CC=CC1
|
|
| MCULE-6201470825 |
0.73 |
O=C1C(CC2CC=CC2)CCC1
|
|
| MCULE-3772551936 |
0.73 |
C/C(/C)=C/CCC1C(=O)CCC1
|
|
| MCULE-9795786500 |
0.73 |
C/C(/C)=C/CCC1C(=O)CCCCC1
|
|
| MCULE-3939283530 |
0.73 |
CC1C(C=O)(CC2CC=CC2)CCC1
|
|
| MCULE-1397001651 |
0.73 |
CC1CC(C=O)(CC2CC=CC2)CC1
|
|
| MCULE-8673056647 |
0.73 |
CC1C(=O)CCC1CC1CC=CC1
|
|
| MCULE-9846709255 |
0.73 |
CCCC(CCC=C)=O
|
|
| MolPort-013-331-274 |
0.73 |
CCCC(=O)CCC=C
|
|
| MolPort-006-756-047 |
0.72 |
CC1(C)CC(=O)C(CC=C)C(=O)C1
|
|
| MolPort-046-510-916 |
0.72 |
CC(=C)C(=O)CCC(=C)C=C
|
|
| MolPort-035-706-214 |
0.72 |
CC(C)[C@@H]1CC[C@@](C)(C=C)[C@H](C(C)=C)C1=O
|
|
| MCULE-3839963678 |
0.72 |
C(C)(CC(C)CC/C=C(\C)/C)=O
|
|
| MCULE-7579628425 |
0.72 |
C=C[C@]1(C)CC[C@@H](C(C)C)C(=O)[C@@]1([H])C(C)=C
|
|
| MCULE-5490317685 |
0.72 |
C1(=O)CC(C)(C)CC(=O)C1CC=C
|
|
| MCULE-9002508466 |
0.72 |
O=C1C(CC=C)C(CCC1)=O
|
|
| MolPort-046-153-788 |
0.71 |
CC(=O)CC[C@@H]1[C@H]2CC(=C(C)C)C(=O)C[C@@]12C
|
|
| MolPort-046-153-745 |
0.71 |
C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)C=O
|
|
| MolPort-029-279-084 |
0.71 |
CC(C)CC(=C)C(C)=O
|
|
| MCULE-3589595055 |
0.71 |
CC=CC(CC1CC2C(C2)CC1)=O
|
|
| MCULE-5882877418 |
0.71 |
C/C(/C)=C/C(CC1CC2C(C2)CC1)=O
|
|
| MCULE-3247594562 |
0.71 |
C1(=O)C[C@@]2([C@]([H])(C/C/1=C(\C)/C)[C@@]2([H])CCC(=O)C)C
|
|
| MCULE-7643707180 |
0.71 |
C/C(/C)=C/C(CC1CC2C(C2)C1)=O
|
|
| MCULE-2910442456 |
0.71 |
CC=CC(CC1CC2C(C2)C1)=O
|
|
| MolPort-001-766-015 |
0.70 |
CC1CCC(=C(C)C)C(=O)C1
|
|
| MolPort-020-479-808 |
0.70 |
[Na+].[O-]C=CC(=O)C1CCCCC1
|
|
| MolPort-042-605-493 |
0.70 |
[Na+].[O-]\C=C\C(=O)C1CCCCC1
|
|
| MolPort-001-793-332 |
0.70 |
C[C@@H]1CCC(=C(C)C)C(=O)C1
|
|
| MCULE-4067407974 |
0.70 |
C/C(/C)=C/C(C1C(C(C)(C)C)C1)=O
|
|
| MCULE-3385582028 |
0.70 |
C1(/CC[C@@](CC/1=O)([H])C)=C(\C)/C
|
|
| MCULE-1921650357 |
0.70 |
C1(/CC[C@@](CC/1=O)([H])C)=C(\C)/C
|
|
| MCULE-1952453345 |
0.70 |
C/C(/C)=C/C(C1C(C2CC2)C1)=O
|
|
| MCULE-7703110506 |
0.70 |
CC1CC(C(CC2CC=CC2)=O)CC1
|
|
| MCULE-8388310463 |
0.70 |
CC1C(C(CC2CC=CC2)=O)CCC1
|
|
| MCULE-8303528132 |
0.70 |
CC1(C(CC2CC=CC2)=O)CCCC1
|
|
| MCULE-3057400120 |
0.70 |
C/C(/C)=C/C(CC1C2CCC(CC2)C1)=O
|
|
| MCULE-6326954661 |
0.70 |
C1(/CCC(CC/1=O)([H])C)=C(\C)/C
|
|
| MCULE-2417213379 |
0.70 |
CC1(C(C(CC2CC=CC2)=O)CCC1)C
|
|
| MCULE-2361055754 |
0.70 |
O=C(C1CCCCCC1)CC1CC=CC1
|
|
| MCULE-7382104000 |
0.70 |
CC(C(/C=C(\C)/C)=O)C1CCC1
|
|
| MCULE-7311518942 |
0.70 |
CC=CC(CC1C2CCC(CC2)C1)=O
|
|
| MCULE-2258345539 |
0.70 |
O=CC1(C2CC(CC2)C1)CC1CC=CC1
|
|
| MCULE-7573892943 |
0.70 |
C=CCCC(C1CC1)=O
|
|
| MolPort-011-135-926 |
0.70 |
C=CCCC(=O)C1CC1
|
|
| MolPort-046-594-349 |
0.69 |
CC1C(=O)CCC2C1(C)CCC1C2(C)CCC2(C)CC(C)(CCC=C(C)C)CCC12C
|
|
| MolPort-044-768-330 |
0.69 |
OC=C1CCCCC1=O
|
|
| MolPort-020-005-764 |
0.69 |
C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@@]2(C)CC[C@@]2(C)C[C@](C)(CCC=C(C)C)CC[C@]12C
|
|
| MCULE-9513927762 |
0.69 |
CC1C2(C)CCC3C4(C)CCC(CC/C=C(\C)/C)(C)CC4(C)CCC3(C)C2CCC1=O
|
|
| MCULE-1529769635 |
0.69 |
CC(C(C)=O)CC1CC=CC1
|
|
| MCULE-7703543535 |
0.69 |
C1(C)(CC/C=C(\C)/C)CC(C)(C)CC(=O)C1
|
|
| MCULE-9484484276 |
0.69 |
C1C[C@@]2([H])[C@]3(C)CC[C@@]4(C)C[C@@](CC/C=C(/C)\C)(C)CC[C@]4(C)[C@@]3([H])CC[C@]2(C)[C@@H](C)C1=O
|
|
| MCULE-6380041803 |
0.69 |
N[C@H]1[C@H](CC(C=C)=O)CCC1
|
|
| MCULE-7810108510 |
0.69 |
CC(C(C[C@H]1[C@H](N)CCC1)=O)=C
|
|
| MCULE-3773713594 |
0.69 |
ClC=CC(CC1CCCCCC1)=O
|
|
| MCULE-8497648230 |
0.69 |
N[C@H]1[C@@H](C(C=C)=O)CCC1
|
|
| MCULE-2860451185 |
0.69 |
CC(C([C@H]1[C@@H](N)CCC1)=O)=C
|
|
| MCULE-3300513366 |
0.69 |
C1(=C)[C@@H]2C[C@@]3(CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(O)=O)[C@@H]3CC2)C1
|
|
| MCULE-5456178986 |
0.69 |
OC(=O)[C@]1([C@]2(CC[C@]34C[C@H](C(=C)C3)CC[C@@]4([H])[C@]2(C)CCC1)[H])C
|
|
| MCULE-3489682457 |
0.69 |
C[C@H]1C(C)(C)[C@](C(C=CCl)=O)(C)CC1
|
|
| MCULE-7730890386 |
0.69 |
CC1C(C)(C)C(C(C=CCl)=O)(C)CC1
|
|
| MCULE-8146991854 |
0.69 |
CC1(C(C=CCl)=O)CCCC1
|
|
| MCULE-3174021569 |
0.69 |
OC(=O)[C@]1([C@]2(CC[C@]34C[C@H](C(=C)C3)CC[C@@]4([H])[C@]2(C)CCC1)[H])C
|
|
| MCULE-6030418096 |
0.69 |
CC(C(CC1C(N)CCC1)=O)=C
|
|
| MCULE-4618718536 |
0.69 |
CC1C(C(C=CCl)=O)CCC1
|
|
| MCULE-4640003531 |
0.69 |
C1C[C@@]2(C)C3C4(CCC2[C@@](C(O)=O)(C)C1)CC(=C)C(CC3)C4
|
|
| MCULE-4464032021 |
0.69 |
CC1(C(C(C=CCl)=O)CCC1)C
|
|
| MCULE-7529000647 |
0.69 |
CCC1(C(C=CCl)=O)CCCC1
|
|
| MCULE-9410359340 |
0.69 |
ClC=CC(C1CCCCCC1)=O
|
|
| MCULE-2304133660 |
0.69 |
NC1C(CC(C=C)=O)CCC1
|
|
| MolPort-044-723-330 |
0.69 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
| MolPort-001-740-928 |
0.69 |
C[C@@]12CCC[C@](C)(C1CCC13CC(CCC21)C(=C)C3)C(O)=O
|
|
| MolPort-039-052-710 |
0.69 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)C3)C(O)=O
|
|
| MolPort-003-930-838 |
0.68 |
CC(=C)CCC(C)=O
|
|
| MolPort-013-331-364 |
0.68 |
CCC(=O)CCC=C
|
|
| MolPort-001-792-412 |
0.68 |
C[C@@H](CCC=C(C)C)CC=O
|
|
| MolPort-001-787-552 |
0.68 |
CC(CCC=C(C)C)CC=O
|
|
| MolPort-039-239-671 |
0.68 |
CC(CCC=C(C)C)C(C)C=O
|
|
| MolPort-001-793-058 |
0.68 |
C[C@H](CCC=C(C)C)CC=O
|
|
| MCULE-3407993112 |
0.68 |
CC(C1(C(C(C)=C)=O)CC1)C
|
|
| MCULE-5875470935 |
0.68 |
O=C(CC)C(C)(C)CC=C
|
|
| MCULE-5395136417 |
0.68 |
[H]C1(C)C2(CCC3(C)C(C(C)C=CC(C)C(C)C)CCC3C2CCC1=O)[H]
|
|
| MCULE-3707649630 |
0.68 |
C(=O)(C=C)CCCCCC(=O)O
|
|
| MCULE-5459126693 |
0.68 |
O=C(C1C2CC(CC2)C1)CC1CC=CC1
|
|
| MCULE-9061110786 |
0.68 |
C(=C(/C)\C)\C(=O)C1CCC(CC1)=O
|
|
| MCULE-7459604539 |
0.68 |
O=C1C(CC2CC=CCC2)CCCCC1
|
|
| MCULE-4641005233 |
0.68 |
O=CC1(CCCC1)CC1CC=CCC1
|
|
| MCULE-1031499239 |
0.68 |
CC1(CC(=O)CC1)CC1CC=CCC1
|
|
| MCULE-9608185744 |
0.68 |
CC1CC(C=O)(CC2CC=CCC2)CC1
|
|
| MCULE-7908633302 |
0.68 |
CC1C(C=O)(CC2CC=CCC2)CCC1
|
|
| MCULE-8979245765 |
0.68 |
O=C1C(CC2CC=CCC2)CCC1
|
|
| MCULE-2076771260 |
0.68 |
O=C1CC(CC2CC=CCC2)CCCC1
|
|
| MCULE-3486573074 |
0.68 |
CC1C(=O)CCC1CC1CC=CCC1
|
|
| MCULE-9675199623 |
0.68 |
ClC=CC(C1C2C3CC(C12)CC3)=O
|
|
| MolPort-004-748-423 |
0.68 |
CC(C)=CC(=O)C1CCC(=O)CC1
|
|
| MolPort-046-691-207 |
0.68 |
CC(C)[C@@H](C)\C=C\[C@@H](C)[C@H]1CC[C@H]2C(=O)CCC[C@]12C
|
|
| MCULE-2742423586 |
0.67 |
O=C1CCCCCCCC=CCCCCCCC1
|
|
| MCULE-9566632126 |
0.67 |
CC1C(C=O)(CC2CC=CC2)CCCC1
|
|
| MCULE-4533311081 |
0.67 |
CC1CC(CC/C=C(\C)/C)C(=O)CC1
|
|
| MCULE-8658586385 |
0.67 |
ClC=CC(C1C2CC(CC2)C1)=O
|
|
| MCULE-7136129743 |
0.67 |
CC1CC(C=O)(CC2CC=CC2)CCC1
|
|
| MCULE-1000113657 |
0.67 |
CC(C1(CC1)CC1CC=CC1)=O
|
|
| MCULE-9964577766 |
0.67 |
CC1CC(CC2CC=CC2)C(=O)CC1
|
|
| MCULE-4119972169 |
0.67 |
O=CC1(CCCCC1)CC1CC=CC1
|
|
| MCULE-6392382167 |
0.67 |
CC(C(CC1CC=CC1)=O)=C
|
|
| MCULE-4262116391 |
0.67 |
N[C@H](C(C(C)=C)=O)CC(C)C
|
|
| MCULE-9493184913 |
0.67 |
O=CC1(CC1)CC1CC=CC1
|
|
| MCULE-5668746450 |
0.67 |
C(=CCCCC)CCCCCCCCCC=O
|
|
| MCULE-9564685678 |
0.67 |
C(CCCCCCCC=CCCCCCCCC)(CCCCCCCC=CCCCCCCCC)=O
|
|
| MCULE-1243509764 |
0.67 |
C/C(/C)=C/CCC1C(=O)CCCC1
|
|
| MCULE-4054434573 |
0.67 |
FC1(C2C1CC(C(C=C)=O)C2)F
|
|
| MCULE-8147840463 |
0.67 |
CC(C(C1CC2C(F)(F)C2C1)=O)=C
|
|
| MolPort-046-736-667 |
0.67 |
O=C1CCCCCC11CCCC1
|
|
| MolPort-022-880-989 |
0.67 |
O=C1CCCCCCC\C=C/CCCCCCC1
|
|
| MolPort-022-258-168 |
0.67 |
O=C1CC2CCCCCC2C1
|
|
| MolPort-006-131-526 |
0.67 |
CCCC\C=C/CCCCCCCCCCCC=O
|
|
| MolPort-003-928-545 |
0.67 |
CCCC\C=C/CCCCCCCCCC=O
|
|
| MolPort-027-120-424 |
0.67 |
CC(C)CC(=O)C=C
|
|
| MolPort-006-112-855 |
0.67 |
CCCC(=C)C=O
|
|
| MolPort-006-133-633 |
0.67 |
CCCCCC\C=C/CCCCCC=O
|
|
| MolPort-020-087-463 |
0.67 |
[Na+].[O-]C=C1CCCCC1=O
|
|
| MCULE-3080370181 |
0.66 |
C1CC2(CC(=O)CC2(C)CC=1)C
|
|
| MCULE-4497166061 |
0.66 |
ClC=CC(C1CCCCCCC1)=O
|
|
| MCULE-5661083032 |
0.66 |
CC1C(C(CC2CC=CCC2)=O)CCC1
|
|
| MCULE-3227878705 |
0.66 |
[H]C12CC=CCC1(C)C1CCC3(C)C(CCC3C1CC2)=O
|
|
| MCULE-2484766562 |
0.66 |
C1C[C@@]2([C@]3(CC[C@@]4([C@]5([C@H](C(C)=C)CC[C@]5(C=O)CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)(C)[C@H]1O)[H])[H])[H])C
|
|
| MCULE-5790792765 |
0.66 |
O=C1C(CC2C3C=CC(CC3)C2)CCC1
|
|
| MCULE-5966520622 |
0.66 |
C1C[C@@]2([H])[C@](C)(CC=1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)C(=O)CC3)CC2
|
|
| MCULE-4014926214 |
0.66 |
CC1CC(C(CC2CC=CCC2)=O)CC1
|
|
| MCULE-4409286429 |
0.66 |
O=C1CCC2(C)C1(CCC1(C)C3(C)CCC4(C)CCC(C)(C)CC4(C3=CCC21)[H])[H]
|
|
| MCULE-8573249352 |
0.66 |
[H]C12CC=CCC1(C)C1CCC3(C)C(CCC3C1CC2)C(C)=O
|
|
| MCULE-9756913466 |
0.66 |
C12CCC3=CCCCC3C1CCC1(C)C(CCC21)=O
|
|
| MCULE-6026959980 |
0.66 |
C12CC1C(=O)C(/C=C(\C)/C)C2
|
|
| MCULE-8109491654 |
0.66 |
[C@]12(C)CC[C@H]3[C@@]([H])(CC[C@@]4([H])CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
| MCULE-1842062313 |
0.66 |
CC1(C(CC2CC=CCC2)=O)CCCC1
|
|
| MCULE-1753922453 |
0.66 |
[H][C@@]12[C@]3(CC[C@]4([C@](C)([C@]3(C)CC[C@@]1(C=O)CC[C@H]2C(=C)C)CC[C@]1([H])[C@@]4(CC[C@@H](C1(C)C)O)C)[H])[H]
|
|
| MCULE-3814030883 |
0.66 |
[C@]12(C)CCC3[C@@]([H])(CC[C@@]4([H])CC=CC[C@]34C)C1CCC2=O
|
|
| MCULE-3657021044 |
0.66 |
O=C(C1C2C1CCCC2)CC1CC=CC1
|
|
| MCULE-6337171250 |
0.66 |
[C@]12(C)CC[C@]3([C@@]([H])(CC[C@@]4([H])CC=CC[C@]34C)[C@]1([H])CC[C@@H]2C(C)=O)[H]
|
|
| MCULE-8357419701 |
0.66 |
O=C(C1C2C1CCC2)CC1CC=CC1
|
|
| MolPort-007-980-904 |
0.66 |
CC(=C)C1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12)C=O
|
|
| MolPort-023-299-061 |
0.66 |
C[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(=C)CO
|
|
| MolPort-002-911-107 |
0.66 |
CC12CCC3C(CCC4=CCCCC34)C1CCC2=O
|
|
| MolPort-046-762-299 |
0.66 |
C[C@]12CC[C@@H]3[C@@H](CC[C@@H]4CC=CC[C@]34C)[C@H]1CCC2=O
|
|
| MolPort-020-007-892 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CCC4CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
| MolPort-046-596-343 |
0.66 |
C[C@]12CCC3C(CC[C@H]4CC=CC[C@]34C)C1CCC2=O
|
|
| MolPort-009-018-267 |
0.66 |
CCCCCC(=O)\C=C/C=O
|
|
| MolPort-002-509-792 |
0.66 |
C[C@]12CCC3[C@@H](CC[C@H]4CC=CC[C@]34C)C1CCC2=O
|
|
| MolPort-005-932-642 |
0.66 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC=CC[C@]34C)[C@@H]1CCC2=O
|
|
| MolPort-027-637-299 |
0.66 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C=O
|
|
| MolPort-046-674-687 |
0.66 |
O=C1CC2CC=CCC2C1
|
|
| MolPort-004-769-599 |
0.65 |
CC(=O)C1CC(=C)C1
|
|
| MolPort-013-676-582 |
0.65 |
C=CCC(=O)C1CC1
|
|
| MCULE-9168539946 |
0.65 |
FC(C(C([C@H]1C[C@@H]2[C@@H](C2)C1)=O)=C)(F)F
|
|
| MCULE-1390320216 |
0.65 |
FC(C(C(C12CCCC1C2)=O)=C)(F)F
|
|
| MCULE-9706743745 |
0.65 |
C1C[C@]2(C)[C@]3([H])CC[C@@]4(O)C(=C)C[C@@]3(C4)CC[C@]2([H])[C@](C)(C(=O)O)C1
|
|
| MCULE-8251326522 |
0.65 |
C=C1C[C@@]23[C@](CC[C@@]1(C2)O)([H])[C@@]1(C)[C@]([C@@](CCC1)(C(=O)O)C)([H])CC3
|
|
| MCULE-6730559555 |
0.65 |
ClC=CC(C1C2C1CCCC2)=O
|
|
| MCULE-6339641467 |
0.65 |
C12(C)C(CCC3C1CCC1(C3CCC1(C)O)C)CC(C(=CO)C2)=O
|
|
| MCULE-1233983645 |
0.65 |
CC12C3CCC4(O)C(CC3(C4)CCC1C(C(O)=O)(C)CCC2)=C
|
|
| MCULE-6325460548 |
0.65 |
[C@]12(C)[C@@]([H])(CC[C@]3([H])[C@]1([H])CC[C@]1([C@@]3([H])CC[C@]1(C)O)C)CC(C(=CO)C2)=O
|
|
| MCULE-2845490138 |
0.65 |
[C@]123CC[C@H](C1)C(C(=C)[C@@]2([H])CC[C@@H]3C(O)=O)(C)C
|
|
| MCULE-8032879920 |
0.65 |
FC(C(C(C1C2C(C2)CCC1)=O)=C)(F)F
|
|
| MCULE-8672084187 |
0.65 |
ClC=CC(C1C2C(C2)CCC1)=O
|
|
| MCULE-7999733772 |
0.65 |
C1CCCCCC2C(C)(C)CC(=O)C2=CCCC1
|
|
| MCULE-3735012527 |
0.65 |
C[C@@]1([C@@]2([H])[C@]([C@]3(CC[C@@]4(C[C@]3(CC2)CC4=C)O)[H])(C)CCC1)C(=O)O
|
|
| MCULE-7532043960 |
0.65 |
ClC=CC(C1CC2C(C2)CC1)=O
|
|
| MCULE-5888690922 |
0.65 |
FC(C(C(C12CCCCC1C2)=O)=C)(F)F
|
|
| MCULE-2900076638 |
0.65 |
FC(C(C(C1CC2C(C2)CC1)=O)=C)(F)F
|
|
| MCULE-8654428932 |
0.65 |
ClC=CC(C1CC2C(C2)C1)=O
|
|
| MCULE-5848120811 |
0.65 |
C1(=C)C2CCC1CC(C(O)=O)C2
|
|
| MCULE-1337085089 |
0.65 |
[C@]12(C)[C@@]([H])(CCC3C1CC[C@]1(C3CC[C@]1(C)O)C)CC(C(=CO)C2)=O
|
|
| MCULE-5010376094 |
0.65 |
ClC=CC(C1C2C1CCC2)=O
|
|
| MCULE-3424301762 |
0.65 |
ClC=CC(C12CCCCC1C2)=O
|
|
| MCULE-4005939250 |
0.65 |
C12(C)CCC3C(CCC4CCCCC34C)C1CC(=CC(C)C)C2=O
|
|
| MCULE-2553466512 |
0.65 |
ClC=CC(C12CCCC1C2)=O
|
|
| MolPort-001-742-556 |
0.65 |
CC1(C)[C@@H]2CC[C@]3(C2)[C@H](CC[C@@H]3C1=C)C(O)=O
|
|
| MolPort-027-835-542 |
0.65 |
C[C@]12CCC[C@](C)([C@@H]1CC[C@]13CC(=C)[C@@](O)(C1)CC[C@H]23)C(O)=O
|
|
| MolPort-046-594-199 |
0.65 |
CC12CCCC(C)(C1CCC13CC(=C)C(O)(C1)CCC23)C(O)=O
|
|
| MolPort-046-156-337 |
0.65 |
C[C@@]1(O)CC[C@H]2[C@@H]3CCC4CC(=O)\C(C[C@]4(C)[C@H]3CC[C@]12C)=C/O
|
|
| MolPort-006-830-022 |
0.65 |
C[C@]1(O)CCC2C3CC[C@H]4CC(=O)\C(C[C@]4(C)C3CC[C@]12C)=C\O
|
|
| MolPort-046-153-069 |
0.65 |
C[C@]12CCC[C@](C)([C@H]1CC[C@@]13CC(=C)[C@@](O)(C1)CC[C@@H]23)C(O)=O
|
|
| MolPort-039-338-304 |
0.65 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)[C@@H]3O)C(O)=O
|
|
| MolPort-039-052-637 |
0.65 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)[C@H]3O)C(O)=O
|
|
| MolPort-005-976-303 |
0.65 |
CC1(O)CCC2C3CCC4CC(=O)\C(CC4(C)C3CCC12C)=C\O
|
|
| MolPort-003-959-059 |
0.65 |
C[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4CC(=O)\C(C[C@]4(C)[C@H]3CC[C@]12C)=C/O
|
|
| MolPort-020-005-960 |
0.65 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13CC(=C)[C@@](O)(C1)CC[C@@H]23)C(O)=O
|
|
| MolPort-023-213-102 |
0.64 |
CC(=C)CCCCCCC(O)=O
|
|
| MolPort-003-926-950 |
0.64 |
ClC(=O)CCCCCCCCC=C
|
|
| MolPort-006-069-065 |
0.64 |
OC(=O)CCCCCCCCCC=C
|
|
| MolPort-023-213-092 |
0.64 |
OC(=O)CCCCCC=C
|
|
| MolPort-023-213-093 |
0.64 |
OC(=O)CCCCCCC=C
|
|
| MolPort-023-213-100 |
0.64 |
CC(=C)CCCCC(O)=O
|
|
| MolPort-023-213-101 |
0.64 |
CC(=C)CCCCCC(O)=O
|
|
| MolPort-035-706-318 |
0.64 |
CC1(C)[C@@H](O)CC[C@]2(C)[C@@H](CC[C@H]3C(=O)CC[C@H]4C(C)(C)[C@@H](O)CC[C@]34C)C(=C)CC[C@@H]12
|
|
| MolPort-000-153-810 |
0.64 |
OC(=O)CCCCCCCC=C
|
|
| MolPort-028-746-650 |
0.64 |
OC(=O)CCCCCCCCCCCCC=C
|
|
| MolPort-002-507-392 |
0.64 |
OC(=O)CCCCCCCCC=C
|
|
| MolPort-002-894-354 |
0.64 |
OC(=O)CCCCCCCC(=O)CCCCCCCCC=C
|
|
| MCULE-1403801057 |
0.64 |
C(CCCCCC(=O)O)CCCCCCC=C
|
|
| MCULE-4736378843 |
0.64 |
CC(C=O)(CC1CC=CCC1)C
|
|
| MCULE-3892173219 |
0.64 |
C(CCCCCCCC=C)(O)=O
|
|
| MCULE-2990920571 |
0.64 |
CC1(C(CC2CC=CC2)=O)CCCCC1
|
|
| MCULE-6863504457 |
0.64 |
O=C(CCCCC(O)=O)CCCCCCCCC=C
|
|
| MCULE-6571932731 |
0.64 |
C=CCCCCCC(=O)O
|
|
| MCULE-2837812117 |
0.64 |
C=C(C)CCCCC(=O)O
|
|
| MCULE-1433114220 |
0.64 |
O=C(C1CC2(CCC2)C1)CC1CC=CC1
|
|
| MCULE-8227436556 |
0.64 |
C1(=O)CCCC=CCCCCCCCCCC1
|
|
| MCULE-4078078854 |
0.64 |
CC(C(C)=O)CC1CC=CCC1
|
|
| MCULE-1643300518 |
0.64 |
C(CCCCCCCCC=C)(Cl)=O
|
|
| MCULE-7928135942 |
0.64 |
C(CCCCCCCCC=C)(O)=O
|
|
| MCULE-7974840074 |
0.64 |
C(CCCCCCCCC(CCCCCC(O)=O)=O)=C
|
|
| MCULE-9714012387 |
0.64 |
C(CCCCCCC(=O)O)C(=O)CCCCCCCCC=C
|
|
| MCULE-2069893872 |
0.64 |
C(CCCCCCCCC=C)(N)=O
|
|
| MCULE-6091105789 |
0.64 |
C=C(CCCCCC(=O)O)C
|
|
| MCULE-1157251692 |
0.64 |
C=C1[C@]2(CCCC([C@]3([H])[C@@]2([H])CC[C@]13[H])(C)C)C
|
|
| MCULE-5123015554 |
0.64 |
C12(C=O)CC3(C1(C)CCC23)C
|
|
| MCULE-9036280749 |
0.64 |
C=C1[C@]2(CCCC([C@@]3([H])[C@@]2([H])CC[C@]13[H])(C)C)C
|
|
| MCULE-7387433305 |
0.64 |
C12CC(CC1)CC(=O)C2
|
|
| MCULE-5308527620 |
0.64 |
CCCC(C1CC2CC(CC2)C1)=O
|
|
| MCULE-7889369700 |
0.64 |
C12C3C4C5C(C(C(=O)C1=O)C4CC3)CCC25
|
|
| MCULE-6565157847 |
0.64 |
CC(C1CC2CC(CC2)C1)=O
|
|
| MCULE-3244665679 |
0.64 |
CCC(C1CC2CC(CC2)C1)=O
|
|
| MCULE-7872665745 |
0.64 |
CC(CC(C1CC2CC(CC2)C1)=O)C
|
|
| MCULE-2106190761 |
0.64 |
CC(C(C1CC2CC(CC2)C1)=O)C
|
|
| MCULE-2865261477 |
0.64 |
O=CC1CC2CC(CC2)C1
|
|
| MCULE-8049841807 |
0.64 |
[C@]12(CCC[C@@]3([C@@](C)(CCC31)C2)C)C(C)=C
|
|
| MCULE-3675031410 |
0.64 |
C=C1CC2CC(CC2)C1
|
|
| MCULE-1018579619 |
0.64 |
C12(C)CCC(CC(C=O)C1)C2(C)C
|
|
| MCULE-5842842686 |
0.64 |
C12(C)C3C4C5C(C(C(=O)C1=O)(C)C4C1CCCC31)C1CCCC1C25
|
|
| MCULE-4792855776 |
0.64 |
C12(C)C(=O)CCC(CC1)C2(C)C
|
|
| MCULE-6744449389 |
0.64 |
O=C1C2C3C4CC5C(C14)C2CC53
|
|
| MCULE-1376695806 |
0.64 |
C12(C)CCC(CC(=O)C1)C2(C)C
|
|
| MCULE-3532876555 |
0.64 |
CC(C1(C(C=C)=O)CC1)C
|
|
| MCULE-1019887621 |
0.64 |
C=C1[C@]2(CCCC([C@]3([H])[C@@]2([H])CC[C@]13[H])(C)C)C
|
|
| MCULE-7277634791 |
0.64 |
[C@H]12[C@]3([H])[C@H](C)CC[C@@]3([H])C(CC[C@H]1C2(C)C)=C
|
|
| MCULE-4192176527 |
0.64 |
C1(=O)C2CCCC1CC2
|
|
| MCULE-2025619273 |
0.64 |
O=C1CC2(C(C)(CCC1)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1CC2)[H]
|
|
| MolPort-027-585-117 |
0.64 |
C=CC(=O)C1CC1
|
|
| MolPort-002-133-136 |
0.64 |
O=C1C2C3CC4C5CC(C24)C1C35
|
|
| MolPort-037-962-616 |
0.64 |
O=C1C2CCC1CCC2
|
|
| MolPort-022-365-357 |
0.64 |
CC(C)(CCC=C)C=O
|
|
| MolPort-042-621-716 |
0.64 |
CC1(C)[C@@H]2CCC[C@@H]2C1=O
|
|
| MolPort-006-112-367 |
0.64 |
C=CCCCC=O
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|
| MolPort-021-996-178 |
0.64 |
O=C1CC2CCC2C1
|
|
| MolPort-042-678-247 |
0.64 |
O=C1C[C@H]2CC[C@H](C2)C1
|
|
| MolPort-021-452-758 |
0.64 |
CC(CCC=C)C=O
|
|
| MolPort-002-511-771 |
0.64 |
C[C@]12CCCC(C)(C)[C@H]3C(CCC13)C2=C
|
|
| MolPort-044-615-199 |
0.64 |
O=C1C[C@@H]2CCC[C@H]12
|
|
| MolPort-046-148-273 |
0.64 |
O=C1C[C@@H]2CC[C@@H]2C1
|
|
| MolPort-046-196-927 |
0.64 |
C[C@]12CCCC(C)(C)[C@H]3[C@H](CC[C@@H]13)C2=C
|
|
| MolPort-001-762-332 |
0.64 |
O=C1CCC2CCC1C2
|
|
| MolPort-035-921-580 |
0.64 |
O=C1CC[C@@H]2CC[C@H]12
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|
| MolPort-022-878-923 |
0.64 |
O=C1CC2CCC(C2)C1
|
|
| MolPort-002-512-059 |
0.64 |
CC(=C)[C@]12C[C@]3(C)CCC1[C@]3(C)CCC2
|
|
| MolPort-002-526-860 |
0.64 |
C[C@@H]1CC[C@@H]2[C@@H]1[C@H]1[C@@H](CCC2=C)C1(C)C
|
|
| MolPort-002-904-206 |
0.64 |
O=C1CC2CC3CC(C2)C1C3
|
|
| MolPort-002-799-488 |
0.64 |
C[C@@H]1CC[C@@H]2[C@@H]1[C@@H](CCCC2=O)C(C)=O
|
|
| MolPort-046-790-393 |
0.63 |
CC(C)=C1C[C@H]2C(=C)CCC[C@]2(C)CC1=O
|
|
| MolPort-046-764-482 |
0.63 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC(=C)[C@]34C)[C@@H]1CCC2=O
|
|
| MolPort-016-579-165 |
0.63 |
O=C\C1=C\CCCCCC1
|
|
| MolPort-019-936-770 |
0.63 |
CC(=O)C1CCC2(C)C3=C(CCC12C)C1(C)CCC(=O)C(C)(C)C1CC3
|
|
| MolPort-035-706-381 |
0.63 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)[C@H](O)CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-002-537-209 |
0.63 |
CC(=O)C1=C/CCCCCCCCCC\1
|
|
| MolPort-035-706-300 |
0.63 |
CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
|
|
| MolPort-002-510-659 |
0.63 |
CC(=O)[C@H]1CCC2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)C3=CC[C@]12C
|
|
| MolPort-004-769-150 |
0.63 |
OC(=O)C1(CC=C)CCCC1
|
|
| MCULE-3433190262 |
0.63 |
C1(CCCCCCCCCCC=1)C(C)=O
|
|
| MCULE-9444397237 |
0.63 |
C1CCC(=O)C=CCCC1
|
|
| MCULE-9946565353 |
0.63 |
ClC=CC(CC1CCC1)=O
|
|
| MCULE-5212919737 |
0.63 |
CC(C(CC1C2C=CC(CC2)C1)=O)=C
|
|
| MCULE-6554886023 |
0.63 |
CC1CCC(C(C=CCl)=O)CC1
|
|
| MCULE-7281525757 |
0.63 |
C1(C)(C)C(CCC1=C)CC(O)=O
|
|
| MCULE-8920554029 |
0.63 |
CCC1CCC(C(C=CCl)=O)CC1
|
|
| MCULE-3804311142 |
0.63 |
C1C2CC(CC(=O)C)C(C2)C=1
|
|
| MCULE-4540266032 |
0.63 |
C(O)(=O)CC1CCCC1C=C
|
|
| MCULE-3118620223 |
0.63 |
CC1(C(C=C)=O)C(N)CCCC1
|
|
| MCULE-9803456437 |
0.63 |
CC(C(C1(CC2(CCC2)C1)N)=O)=C
|
|
| MCULE-8714614317 |
0.63 |
C=CC(CC1C2C=CC(CC2)C1)=O
|
|
| MCULE-9278903355 |
0.63 |
ClC=CC(C12CC3CC(C1)CC(C3)C2)=O
|
|
| MCULE-6178918262 |
0.63 |
ClC=CC(C1CC2C(CCCC2)CC1)=O
|
|
| MCULE-4332043926 |
0.63 |
CC1(C(C=CCl)=O)CCCCC1
|
|
| MCULE-4639928435 |
0.63 |
C1CC2(C)C3CCC4(C)C(C(C)=O)CCC4(C)C=3CCC2C(C)(C)C1=O
|
|
| MCULE-2263462068 |
0.63 |
CC[C@H]1[C@H](C(C=CCl)=O)C1
|
|
| MCULE-1479595180 |
0.63 |
CC(C(C=CCl)=O)(C1CCC1)C
|
|
| MCULE-2890629990 |
0.63 |
CC(C1CCC(C(C=CCl)=O)CC1)(C)C
|
|
| MCULE-4702029065 |
0.63 |
CCC1C(C(C=CCl)=O)C1
|
|
| MCULE-7615016298 |
0.63 |
CC1(C(C(C=CCl)=O)CCCC1)C
|
|
| MCULE-7428197467 |
0.63 |
ClC=CC(C1C(C2CC2)C1)=O
|
|
| MCULE-6703847656 |
0.63 |
ClC=CC(C1C2CCC(CC2)C1)=O
|
|
| MCULE-5841728721 |
0.63 |
O=C1CC2(CC=C3C4CCC(C(C)CCC(C)C(C)C)C4(C)CCC3C2(C)C1)[H]
|
|
| MCULE-5899346849 |
0.63 |
CC(C(C1(C(N)CCCC1)C)=O)=C
|
|
| MCULE-7848825627 |
0.63 |
CC(C(C=CCl)=O)C1CCC1
|
|
| MCULE-5925261890 |
0.63 |
CC[C@@H]1CC[C@@H](C(C=CCl)=O)CC1
|
|
| MCULE-8638061457 |
0.63 |
CC1CC(C(C=CCl)=O)CCC1
|
|
| MCULE-2891245015 |
0.63 |
ClC=CC(C1C2CC3CC(C2)CC1C3)=O
|
|
| MCULE-2946755851 |
0.63 |
FC(C(C(C1CC2(CCC2)C1)=O)=C)(F)F
|
|
| MCULE-4147821095 |
0.63 |
FC(C(C(C1C2(CC2)C1)=O)=C)(F)F
|
|
| MCULE-8762903723 |
0.63 |
CC(C1C(C(C=CCl)=O)C1)(C)C
|
|
| MCULE-5595700484 |
0.63 |
[H]C12CC=CCC1(C)C1CCC3(C)CCCC3C1C(C2)=O
|
|
| MCULE-2059287014 |
0.63 |
N[C@H]1[C@@H](C(CC=C)=O)CCC1
|
|
| MCULE-3035020921 |
0.63 |
C1CCCCC=C(C=O)C1
|
|
| MCULE-2525498529 |
0.63 |
C=CC(CC1CC=CC1)=O
|
|
| MCULE-8631883359 |
0.63 |
CC(C(CC1CC=CC1)=O)(C)C
|
|
| MolPort-046-672-833 |
0.63 |
CCC(=O)C(C)C\C(C)=C\C
|
|
| MolPort-019-992-002 |
0.63 |
O=C1CCC2(CCCC2)C=C1
|
|
| MolPort-046-646-770 |
0.63 |
O=C1CC2(CCCCCC2)C=C1
|
|
| MolPort-046-774-258 |
0.63 |
O=C1CCC2(CCCCCC2)C=C1
|
|
| MolPort-028-754-122 |
0.63 |
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O)[C@@]4(C)C(O)=O
|
|
| MolPort-022-257-993 |
0.63 |
O=C1CC2CCCCCC2=C1
|
|
| MolPort-046-508-800 |
0.63 |
O=C1CC2(CCCC2)C=C1
|
|
| MolPort-027-640-633 |
0.62 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)=C2C1
|
|
| MolPort-001-742-582 |
0.62 |
CC(CCO)CC[C@@H]1C(=C)CC[C@H]2[C@@]1(C)CCC[C@@]2(C)C(O)=O
|
|
| MolPort-002-509-734 |
0.62 |
[K+].[O-]C(=O)CCCCCCCCC=C
|
|
| MolPort-046-647-152 |
0.62 |
OC(=O)C1CC2(C1)CC(=C)C2
|
|
| MolPort-039-052-597 |
0.62 |
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
|
|
| MolPort-039-052-487 |
0.62 |
CC1(C)CC[C@]2(C)CC=C3[C@]4(C)CC[C@H]5C(C)(C)C(=O)CC[C@]5(C)[C@H]4CC[C@@]3(C)[C@@H]2C1
|
|
| MolPort-003-666-886 |
0.62 |
[Zn++].[O-]C(=O)CCCCCCCCC=C.[O-]C(=O)CCCCCCCCC=C
|
|
| MolPort-003-940-301 |
0.62 |
C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)CC[C@]34C)[C@@H]1CC=C2
|
|
| MolPort-029-943-094 |
0.62 |
CC(CCC1C(=C)CCC2C1(C)CCCC2(C)C(O)=O)CC(O)=O
|
|
| MolPort-035-705-910 |
0.62 |
C[C@@H](CCO)CC[C@H]1C(=C)CC[C@@H]2[C@]1(C)CCC[C@]2(C)C(O)=O
|
|
| MolPort-023-274-294 |
0.62 |
CC(CCO)CCC1C(=C)CCC2C(C)(C)CC(=O)CC12C
|
|
| MolPort-003-922-566 |
0.62 |
O=C1CCCCC\C=C/CC1
|
|
| MCULE-4888197133 |
0.62 |
C1(=O)CC2(C)C(CCC(C)CCO)C(=C)CCC2C(C)(C)C1
|
|
| MCULE-2936092419 |
0.62 |
CC(C(C)=O)CC1C2C=CC(CC2)C1
|
|
| MCULE-4393909687 |
0.62 |
C1CC2(C)C(CCC(C)CC(=O)O)C(=C)CCC2C(C)(C(=O)O)C1
|
|
| MCULE-6531167311 |
0.62 |
CC(CCC1C2C=CC(CC2)C1)=O
|
|
| MCULE-3639141823 |
0.62 |
CC(C1(CC1)CC1CC=CCC1)=O
|
|
| MCULE-8671525222 |
0.62 |
C(CCCCCCCCC=C)(=O)[O-].[K+]
|
|
| MCULE-2814899152 |
0.62 |
O=CC1(CCCCC1)CC1CC=CCC1
|
|
| MCULE-7704943892 |
0.62 |
C1(CC)CC(=O)CCCCC=C1
|
|
| MCULE-3830868177 |
0.62 |
CC1CC(CC2CC=CCC2)C(=O)CC1
|
|
| MCULE-4713145304 |
0.62 |
C1C[C@]2(C)[C@@]([H])(CC[C@@H](C)CCO)C(=C)CC[C@@]2([H])[C@@](C)(C(O)=O)C1
|
|
| MCULE-6811826956 |
0.62 |
C12(C)CCC(=O)CC1CCC1C3C(CCC21)=C(C)CC3
|
|
| MCULE-4490380859 |
0.62 |
O=C1CCC2(C)C3CC=C4C5(CC(C)(C)CCC5(C)CCC4(C)C3(C)CCC2(C1(C)C)[H])[H]
|
|
| MCULE-4878329713 |
0.62 |
O=CC1(CC1)CC1CC=CCC1
|
|
| MCULE-8330160340 |
0.62 |
[C@@]12(C)CCC[C@@](C)(C(O)=O)[C@@]1([H])CCC(=C)[C@H]2CCC(C)CCO
|
|
| MCULE-5060620930 |
0.62 |
CC(C=O)(CC1C2C=CC(CC2)C1)C
|
|
| MCULE-6093405777 |
0.62 |
CC(CC(C1(C(C)(C)C(C)CC1)C)=O)C
|
|
| MCULE-3185184224 |
0.62 |
C12(CCCC1)CCCC2=O
|
|
| MCULE-8969254617 |
0.62 |
CCC(C(C1(C(C)(C)C(C)CC1)C)=O)C
|
|
| MCULE-1464304007 |
0.62 |
CC(C1CCC(=O)CCC1)(C)C
|
|
| MCULE-5063614730 |
0.62 |
CC(CC(C1C(C)CCCCC1)=O)C
|
|
| MCULE-7048040111 |
0.62 |
C1(CCCC1CCCCC)=O
|
|
| MCULE-6699941490 |
0.62 |
C1(CCCC1CCCCCCC)=O
|
|
| MCULE-8455504217 |
0.62 |
CCC1CC(=O)CC1
|
|
| MCULE-6382907203 |
0.62 |
O=CCC1CCCCCC1
|
|
| MCULE-5898493972 |
0.62 |
O=CCCC1CCCCCC1
|
|
| MCULE-7969593113 |
0.62 |
C(CCCC1CCCCCC1)=C
|
|
| MCULE-7344516120 |
0.62 |
C(CC1CCCCCC1)=C
|
|
| MCULE-1022009945 |
0.62 |
CC(CC(C1CCC(C)CCC1)=O)C
|
|
| MCULE-7294501883 |
0.62 |
C1(CCCCCC1=O)(C)C
|
|
| MCULE-5142465520 |
0.62 |
CC(CC(C1C(C)CC(C)(C)C1)=O)C
|
|
| MCULE-2750232256 |
0.62 |
C1CCCC(C=O)CC1
|
|
| MCULE-8048005034 |
0.62 |
CC(CC([C@@]1(C(C)(C)[C@H](C)CC1)C)=O)C
|
|
| MCULE-7059020810 |
0.62 |
C[C@H]1C(C)(C)[C@](C(C(C)(C)C)=O)(C)CC1
|
|
| MCULE-1678869086 |
0.62 |
O=C(C)CCC1CCCCCC1
|
|
| MCULE-7952211819 |
0.62 |
CC(C1CCCC1)=O
|
|
| MCULE-4829140350 |
0.62 |
O=CCCC1CCCC1
|
|
| MCULE-1497694106 |
0.62 |
CC(CC(C1C2(CCCC2)CCC1)=O)C
|
|
| MCULE-3878267481 |
0.62 |
CC(CC(C1CCC(C)(C)CCC1)=O)C
|
|
| MCULE-3818571620 |
0.62 |
CC(CC(C1CC(C)(C)CC1)=O)C
|
|
| MCULE-6760752163 |
0.62 |
CCC([C@@]1(C(C)(C)[C@H](C)CC1)C)=O
|
|
| MCULE-1756132128 |
0.62 |
CC1C(C)(C)C(C(C(C)(C)C)=O)(C)CC1
|
|
| MCULE-6732010471 |
0.62 |
C1(C)CCC(=C)CCC1
|
|
| MCULE-6488235518 |
0.62 |
C(C)(CCCC1CCCCCC1)=C
|
|
| MCULE-6590200380 |
0.62 |
C(C)(CC1CCCCCC1)=C
|
|
| MCULE-9386490140 |
0.62 |
CC(C1C(=C)CCCCC1)C
|
|
| MCULE-8516946745 |
0.62 |
CC1C(=C)CCCCC1
|
|
| MCULE-5254512060 |
0.62 |
C1(C(C)=O)C(C)CCC1C(C)C
|
|
| MCULE-6722315124 |
0.62 |
C1(C)(C)C(C)CCC1(C)C=O
|
|
| MCULE-2562125583 |
0.62 |
C1(C)(C(C)=O)CCC(C)C1(C)C
|
|
| MCULE-8113761933 |
0.62 |
C1C(=O)C(C2CCCC2)CC1
|
|
| MCULE-4598760531 |
0.62 |
C1CC2CCC3C(=O)CC1C23[H]
|
|
| MCULE-3507111924 |
0.62 |
O=C1CCCCCC1
|
|
| MCULE-1868643843 |
0.62 |
C(CCCC)(C1CCCC1)=O
|
|
| MCULE-9742746469 |
0.62 |
C1(C(C)C)CCC(C1)C=O
|
|
| MCULE-5590026729 |
0.62 |
CC(C1C(=O)CCC1)C
|
|
| MCULE-3748468061 |
0.62 |
CCC1C(=C)CCCCC1
|
|
| MCULE-6306576171 |
0.62 |
C1CC(CC=C)CC1
|
|
| MCULE-9793680877 |
0.62 |
C1(CCC(CCC)C1)=O
|
|
| MCULE-1516592633 |
0.62 |
CCC1C(C=O)CCCCC1
|
|
| MCULE-4431631098 |
0.62 |
CCC(C1CCCC1)=O
|
|
| MCULE-3121577809 |
0.62 |
C12C3C4C5C6C3C3C7C6CCC7C(C6C(=O)C(C5)C4C61)C23
|
|
| MCULE-3994894041 |
0.62 |
C(CCCCCC)(C1CCCC1)=O
|
|
| MCULE-3796324037 |
0.62 |
C1(C)C(=O)CC(C)(C)CCC1
|
|
| MCULE-4828860258 |
0.62 |
CCCC(C1CCCC1)=O
|
|
| MCULE-9971643578 |
0.62 |
CCC1C(C(C(C)C)=O)CCCCC1
|
|
| MCULE-9583532799 |
0.62 |
CCC1C(C(CC)=O)CCCCC1
|
|
| MCULE-5830536761 |
0.62 |
C1CCCC1CC(=O)C
|
|
| MCULE-1927820978 |
0.62 |
CC(C1(CC(=O)CC1)C)C
|
|
| MCULE-3300245474 |
0.62 |
C[C@H]1C(C)(C)[C@](C=O)(C)CC1
|
|
| MCULE-2069559702 |
0.62 |
C1CCC2(CCCC2)C(=O)CCC1
|
|
| MCULE-1884299455 |
0.62 |
CCC1C(=O)CCC1
|
|
| MCULE-4200525092 |
0.62 |
O=C(C1CCCC1)C1CCCC1
|
|
| MCULE-6618468129 |
0.62 |
C1(C)(C)C(CC)CC(=O)C1C
|
|
| MCULE-9636017250 |
0.62 |
C1(C2CCCC2)CCC(=O)C1
|
|
| MCULE-6626560140 |
0.62 |
CC(C(CCC1CCCC1)=O)(C)C
|
|
| MCULE-9980064191 |
0.62 |
C1(CCCC1CCCCCC)=O
|
|
| MCULE-7083115238 |
0.62 |
C=CCCC1CCCCCC1
|
|
| MCULE-7853231747 |
0.62 |
CCCCC1C(=O)CCC1
|
|
| MCULE-6186440440 |
0.62 |
C1(CCCC1CCC)=O
|
|
| MCULE-1966597760 |
0.62 |
C12CCCCCC(C1=O)CC2
|
|
| MCULE-6108875825 |
0.62 |
CC(C1C(C=O)CCCCC1)C
|
|
| MCULE-6462361293 |
0.62 |
CC(C(C1C(C)CCCCC1)=O)C
|
|
| MCULE-8245975301 |
0.62 |
CCC(C1C(C(C)C)CCCCC1)=O
|
|
| MCULE-8734036749 |
0.62 |
CCC(C1(C(C)(C)C(C)CC1)C)=O
|
|
| MCULE-2651443666 |
0.62 |
CCCC(C1C(C)CCCCC1)=O
|
|
| MCULE-9324503120 |
0.62 |
CC(C1CCCCCC1)=O
|
|
| MCULE-2037504747 |
0.62 |
CC1C(C(C)=O)CCCCC1
|
|
| MCULE-8327099465 |
0.62 |
CC(C1C(C(C(C)C)=O)CCCCC1)C
|
|
| MCULE-2083601882 |
0.62 |
CC(CCC1C(=O)CCC1)C
|
|
| MCULE-3362689908 |
0.62 |
CC(C1C(C(C)=O)CCCCC1)C
|
|
| MCULE-1528776487 |
0.62 |
C12(C)CCCC1C(C)(C)CC2=C
|
|
| MCULE-1337960294 |
0.62 |
O=CCC1CCCC1
|
|
| MCULE-7534280669 |
0.62 |
C(CCCCCCC)(C1CCCC1)=O
|
|
| MCULE-7970611652 |
0.62 |
C1(CCCC1CCCCCCCC)=O
|
|
| MCULE-2475156554 |
0.62 |
C[C@H]1C(C)(C)[C@](C(C)=O)(C)CC1
|
|
| MCULE-8903209433 |
0.62 |
C1C[C@]23C[C@@]42CC[C@]2(C)[C@]([C@@H](CCC(=C)C(C)C)C)([H])CC[C@@]2(C)[C@]4([H])CC[C@@]3([H])[C@@](C(=O)O)(C)[C@H]1O
|
|
| MCULE-8557116567 |
0.62 |
C12([H])C(C)CCC1([H])C(C)=CC2=O
|
|
| MCULE-9928356247 |
0.62 |
C12C3C4C5C(C(C(=O)C1=O)C4CC3)C=CC25
|
|
| MCULE-4594101266 |
0.62 |
C1CC2(C)CC(=O)C=C2C1
|
|
| MCULE-9790788139 |
0.62 |
O=C1CC2C3CCC(C(C)CCCC(C)C)C3(C)CCC2C2(C)CCCC=C21
|
|
| MCULE-5189112501 |
0.62 |
C1(=O)C2C3C4C1C1C=CC5C1C4C1C3C2C(=O)C15
|
|
| MCULE-9382333306 |
0.62 |
C1(C)(C)CC(=O)C2=C(C)CCC12
|
|
| MCULE-4852376400 |
0.62 |
O=CCCC1C2C=CC(CC2)C1
|
|
| MCULE-1741751705 |
0.62 |
C[C@]12[C@@]3(CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC=C1[C@H]1[C@H](CCC(C1)(C)C)CC2)C
|
|
| MCULE-7859787767 |
0.62 |
CC(C(CC1CC=CCC1)=O)(C)C
|
|
| MCULE-1556522580 |
0.62 |
C1(=O)CCC=CCCCCC1
|
|
| MCULE-7116827600 |
0.62 |
O=CC1(CCC1)CC1CC=CCC1
|
|
| MCULE-5304256304 |
0.62 |
C(=O)(CCCC=C)CCCCCC(=O)O
|
|
| MolPort-008-155-529 |
0.62 |
O=CCCC1CCCC1
|
|
| MolPort-011-200-645 |
0.62 |
CCC1CCCCCC1=O
|
|
| MolPort-008-545-479 |
0.62 |
CCC(=O)C1CCCC1
|
|
| MolPort-002-563-474 |
0.62 |
CCCCCCC1CCCC1=O
|
|
| MolPort-006-116-554 |
0.62 |
CCC1CCCC1=O
|
|
| MolPort-006-116-092 |
0.62 |
O=CC1CCCCCC1
|
|
| MolPort-001-011-595 |
0.62 |
CCCCCCCCC1CCCC1=O
|
|
| MolPort-001-766-718 |
0.62 |
CCCCCCCC1CCCC1=O
|
|
| MolPort-001-769-691 |
0.62 |
O=C1CCCCCC1
|
|
| MolPort-001-783-544 |
0.62 |
O=CCC1CCCC1
|
|
| MolPort-001-793-047 |
0.62 |
O=C1CCCC1C1CCCC1
|
|
| MolPort-002-501-890 |
0.62 |
CC(=O)CC1CCCC1
|
|
| MolPort-002-506-929 |
0.62 |
CCCCCCC(=O)C1CCCC1
|
|
| MolPort-002-506-969 |
0.62 |
CCCCCCCC(=O)C1CCCC1
|
|
| MolPort-002-506-998 |
0.62 |
CCCCC(=O)C1CCCC1
|
|
| MolPort-002-507-833 |
0.62 |
CCCCCC1CCCC1=O
|
|
| MolPort-011-912-676 |
0.62 |
CCCC(=O)C1CCCC1
|
|
| MolPort-003-179-112 |
0.62 |
O=C1CCC(C1)C1CCCC1
|
|
| MolPort-003-179-113 |
0.62 |
CCCC1CCCC1=O
|
|
| MolPort-003-802-850 |
0.62 |
CC(=O)C1CCCC1
|
|
| MolPort-006-112-676 |
0.62 |
CCCCC1CCCC1=O
|
|
| MolPort-011-284-955 |
0.62 |
CCC1CCC(=O)C1
|
|
| MolPort-000-005-265 |
0.62 |
C=CCC1CCCC1
|
|
| MolPort-011-912-695 |
0.62 |
CC(C)(C)C(=O)C1CCCC1
|
|
| MolPort-022-150-395 |
0.62 |
CCC(=O)C1CCCCCC1
|
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| MolPort-046-688-245 |
0.62 |
O=C1C[C@@H]2CCC[C@@H]2C1
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|
| MolPort-022-879-039 |
0.62 |
O=C1CCCC11CCCC1
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|
| MolPort-029-002-461 |
0.62 |
CC1(C)CCCC(=O)CC1
|
|
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0.62 |
CC[C@@H]1CCCC1=O
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| MolPort-044-422-804 |
0.62 |
O=C1CC[C@@H]2CCC[C@H]12
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|
| MolPort-042-623-998 |
0.62 |
CCC1CCCC(=O)CC1
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|
| MolPort-039-240-570 |
0.62 |
CC1CC2CC(=O)CC2C1
|
|
| MolPort-023-314-323 |
0.62 |
CC(C)C1CCCC(=O)CC1
|
|
| MolPort-023-314-324 |
0.62 |
CC(C)(C)C1CCCC(=O)CC1
|
|
| MolPort-025-073-835 |
0.62 |
CC(=O)C1CCCC(C)(C)CC1
|
|
| MolPort-038-355-048 |
0.62 |
O=C1CCC2(CCCC2)C1
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|
| MolPort-025-529-612 |
0.62 |
CCC(C)C1CCC(=O)C1
|
|
| MolPort-027-458-967 |
0.62 |
O=CCC1CCCCCC1
|
|
| MolPort-012-857-868 |
0.62 |
CC(=O)CCC1CCCC1
|
|
| MolPort-035-291-597 |
0.62 |
O=C(CC1CCCC1)CC1CCCC1
|
|
| MolPort-028-949-200 |
0.62 |
CC1(CCCCCC1)C=O
|
|
| MolPort-028-951-830 |
0.62 |
CC(C)C1(C)CCC(=O)C1
|
|
| MolPort-029-001-495 |
0.62 |
CCC1(C)CCCC1=O
|
|
| MolPort-029-001-496 |
0.62 |
CC1CCCC(=O)CC1
|
|
| MolPort-022-257-083 |
0.62 |
O=C1CC2CCCC2C1
|
|
| MolPort-023-198-335 |
0.62 |
CC(C=O)C1CCCC1
|
|
| MolPort-029-757-905 |
0.62 |
CC1(C)CCCCCC1=O
|
|
| MolPort-021-277-590 |
0.62 |
CC(C)CC1CCC(=O)C1
|
|
| MolPort-014-212-811 |
0.62 |
CC1CCCCCC1=O
|
|
| MolPort-022-147-977 |
0.62 |
CC(=O)C1CCCCCC1
|
|
| MolPort-013-899-316 |
0.62 |
CC(C)C1CCCCCC1=O
|
|
| MolPort-020-915-611 |
0.62 |
CC(=C)C1CCCC1
|
|
| MolPort-014-468-876 |
0.62 |
O=C(C1CCCC1)C1CCCC1
|
|
| MolPort-013-899-289 |
0.62 |
CC(C)C1CCCC1=O
|
|
| MolPort-013-899-300 |
0.62 |
CC(C)(C)C1CCCC1=O
|
|
| MolPort-021-277-609 |
0.62 |
CC(C)C1CCC(=O)C1
|
|
| MolPort-013-677-792 |
0.62 |
CC(C)CC1CCCC1=O
|
|
| MolPort-021-277-641 |
0.62 |
CC(C)CCC1CCC(=O)C1
|
|
| MolPort-013-677-791 |
0.62 |
CC(C)CCC1CCCC1=O
|
|
| MolPort-012-857-870 |
0.62 |
CC(C)(C)C(=O)CCC1CCCC1
|
|
| MolPort-046-158-419 |
0.62 |
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@@H](C[C@H](O)[C@@H]21)C(=C)C3=O)C(O)=O
|
|
| MolPort-046-765-408 |
0.62 |
C[C@]12CC[C@@H]3[C@@H]([C@H]4C[C@H]4C4=CC(=O)CC[C@]34C)[C@H]1[C@@H]1C[C@@H]1C2=O
|
|
| MolPort-027-949-819 |
0.61 |
CCC1(CC)CCC(=O)C=C1
|
|
| MolPort-003-846-085 |
0.61 |
[2H]C([2H])([2H])C1=C(C=O)C(C)(C)CCC1([2H])[2H]
|
|
| MolPort-000-421-911 |
0.61 |
CC1(C)C2CCC(C2)(C(O)=O)C1=C
|
|
| MolPort-035-706-378 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
| MolPort-002-524-807 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-000-421-912 |
0.61 |
CC1(C)C2CCC(C2)(C(N)=O)C1=C
|
|
| MolPort-002-512-343 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-039-033-337 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-039-052-495 |
0.61 |
CC(C)(O)[C@H](O)CCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-001-740-815 |
0.61 |
C[C@@]1(O)CCC[C@]2(C)CC[C@H](C[C@@H]12)C(=C)C(O)=O
|
|
| MolPort-039-052-624 |
0.61 |
CC(=C)[C@@H](O)CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]21C
|
|
| MolPort-000-422-027 |
0.61 |
CC1(C)C2CCC(C2)(C([O-])=O)C1=C
|
|
| MolPort-000-722-317 |
0.61 |
CCCCCC\C=C1/CCCCC1=O
|
|
| MolPort-042-624-120 |
0.61 |
CC(=C)[C@@H]1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-001-817-194 |
0.61 |
CCCCC(CC)\C=C1/CCCCC1=O
|
|
| MolPort-001-794-308 |
0.61 |
CC1=C(C=O)C(C)(C)CCC1
|
|
| MolPort-001-740-747 |
0.61 |
CC1(O)CCCC2(C)CCC(CC12)C(=C)C(O)=O
|
|
| MolPort-044-615-516 |
0.61 |
CC(C)(C)C1CCC(=O)C=C1
|
|
| MolPort-044-623-113 |
0.61 |
CCC1CCC(=O)C=C1
|
|
| MolPort-046-158-394 |
0.61 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]12
|
|
| MolPort-046-426-986 |
0.61 |
CC(=C)C1CCC2(CCC3(C)C(CCC4C5(C)CCC(=O)C(C)(C)C5CCC34C)C12)C(O)=O
|
|
| MolPort-046-646-759 |
0.61 |
O=C1C=CCC11CCCCC1
|
|
| MolPort-001-742-037 |
0.61 |
CC(=C)C1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-001-740-814 |
0.61 |
C[C@]12CC[C@@H](O)C(=C)C1C[C@@H](CC2)C(=C)C(O)=O
|
|
| MolPort-000-811-412 |
0.61 |
CCCCC(CC)\C=C1\CCCCC1=O
|
|
| MolPort-035-706-217 |
0.61 |
C[C@]12CCCC(=C)[C@@H]1C[C@@H](CC2)C(=C)C(O)=O
|
|
| MolPort-002-576-849 |
0.61 |
CC1(C)CC(=O)C(=CN)C(=O)C1
|
|
| MolPort-003-926-743 |
0.61 |
O=C1CCCCC=C1
|
|
| MolPort-007-980-897 |
0.61 |
CC(=C)C1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-046-792-980 |
0.61 |
CCCCCC\C=C1\CCCC1=O
|
|
| MolPort-019-997-682 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
| MolPort-020-858-906 |
0.61 |
O=CC1=CCCCCC1
|
|
| MolPort-021-804-489 |
0.61 |
CC12CCC(O)C(=C)C1CC(CC2)C(=C)C(O)=O
|
|
| MolPort-006-111-488 |
0.61 |
CC(C)C1CCC(=O)C=C1
|
|
| MolPort-005-945-549 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@@]3([C@H](CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O)C(O)=O
|
|
| MolPort-005-944-788 |
0.61 |
CC(=C)[C@H]1CC[C@@]2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
|
|
| MolPort-005-944-694 |
0.61 |
CC(=C)C1CC[C@@]2(CC[C@@]3([C@H](CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O)C(O)=O
|
|
| MolPort-023-197-958 |
0.61 |
CCC1(C)CCC(=O)C=C1
|
|
| MolPort-003-939-279 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
| MolPort-023-276-984 |
0.61 |
CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@H]5CC[C@@]34C)[C@@H]12)C(O)=O
|
|
| MolPort-002-929-501 |
0.61 |
C[C@]1(O)CCC[C@]2(C)CC[C@H](CC12)C(=C)C(O)=O
|
|
| MCULE-2243940623 |
0.61 |
C1CC2CC2CCC(=O)C=1
|
|
| MCULE-5435296062 |
0.61 |
C1(=C/N)/C(=O)CC(CC/1=O)(C)C
|
|
| MCULE-4945902509 |
0.61 |
O=C(C1CC2C(C2)C1)CC1CC=CCC1
|
|
| MCULE-4487348024 |
0.61 |
[C@@]12(C)CCC3(C([C@H](C(C)=C)CC3)C1CCC1C2(C)CCC2C1(C)CCC(=O)C2(C)C)C(=O)[O-]
|
|
| MCULE-3240845890 |
0.61 |
C1C[C@@]2(C)[C@@](C[C@H](C(C(=O)O)=C)CC2)([C@@](C1)(O)C)[H]
|
|
| MCULE-8763282524 |
0.61 |
OC([C@@]12CC[C@@]3(C(O)=O)CCC(C(C)=C)C3[C@@]1([H])CCC1[C@@]2(C)CCC2[C@@]1(CC[C@H](O)C2(C)C)C)=O
|
|
| MCULE-2632444883 |
0.61 |
C12[C@](C)(CCC[C@]1(C)CC[C@H](C2)C(=C)C(O)=O)O
|
|
| MCULE-2989303688 |
0.61 |
C12(CCC(C(C)(C)C1=C)C2)C(N)=O
|
|
| MCULE-4260172884 |
0.61 |
ClC=CC(C1CCC2(CC2)CC1)=O
|
|
| MCULE-2876144776 |
0.61 |
C12(CCC(C(C)(C)C1=C)C2)C(O)=O
|
|
| MCULE-9704056914 |
0.61 |
O=C(C1CCCCCCC=1)C1C2(CC2)C1
|
|
| MCULE-5589267581 |
0.61 |
C1CC2(C)CCC(C(=C)C(=O)O)CC2C(=C)C1O
|
|
| MCULE-9982252588 |
0.61 |
O=C(O)[C@]12[C@]([C@]3(CC[C@@]4([C@]5(CCC(=O)C(C)(C)[C@]5([H])CC[C@@]4(C)[C@]3(C)CC1)C)[H])[H])([H])[C@H](C(=C)C)CC2
|
|
| MCULE-3066570238 |
0.61 |
C(O)(=O)[C@]12CC[C@@H](C(=C)C)[C@]1([H])[C@]1([H])[C@@]([C@]3([C@@](CC1)([H])[C@]1(C)[C@@](C([C@H](CC1)O)(C)C)([H])CC3)C)(C)CC2
|
|
| MCULE-7421072365 |
0.61 |
C12C3C4C5C1C(C1C5C5C4C(CC5C1=O)C3=O)C=C2
|
|
| MCULE-7594121913 |
0.61 |
C1(CCCCC1=O)=CCCCCCC
|
|
| MCULE-9204788308 |
0.61 |
C12C(C)(CCCC1(C)CCC(C2)C(=C)C(O)=O)O
|
|
| MCULE-2320262885 |
0.61 |
CC1C(C=O)(C/C=C(\Cl)/Cl)CCC1
|
|
| MCULE-4187355503 |
0.61 |
CC1CC(C(C2CCCCCCC=2)=O)C1
|
|
| MCULE-8322152301 |
0.61 |
CC(C1C2C3C(C)(CCC2(C(O)=O)CC1)C1(C)C(C2(C)C(CC1)C(C)(C)C(=O)CC2)CC3)=C
|
|
| MCULE-5097841519 |
0.61 |
C1(=O)C([C@]2([C@](C)(CC1)[C@]1([H])[C@@]([C@]3([C@@](CC1)([H])[C@@]1([C@@](CC[C@H]1C(C)=C)(C(O)=O)CC3)[H])C)(C)CC2)[H])(C)C
|
|
| MCULE-5575338469 |
0.61 |
C/C(/C)=C/C(CC1C2C=CC(CC2)C1)=O
|
|
| MCULE-7822581477 |
0.61 |
ClC=CC(C1CC2(CC2)CCC1)=O
|
|
| MCULE-8040115902 |
0.61 |
C(C)(C)(C)C1CC(=C2CCC(CC2)C(C)(C)C)C(CC1)=O
|
|
| MCULE-4948873814 |
0.61 |
C1(CCCCC1=O)=CC(CCCC)CC
|
|
| MCULE-8414068028 |
0.61 |
C1(CCCCCC=1)C=O
|
|
| MCULE-8675761077 |
0.61 |
[C@]12([H])[C@@](C)(CCC[C@]1(C)CC[C@H](C2)C(=C)C(O)=O)O
|
|
| MCULE-5777846017 |
0.61 |
CC1CC(C=O)(C/C=C(\Cl)/Cl)CC1
|
|
| MCULE-6272265532 |
0.61 |
Cl/C(/Cl)=C/CC1(C=O)CCCCCC1
|
|
| MCULE-9601196069 |
0.61 |
C12([H])CC=CC1([H])CC(=O)C2
|
|
| MCULE-2871457061 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4([H])[C@@]5([H])[C@H](C(C)=C)CC[C@@]5(CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C([C@@H]1O)(C)C)C(O)=O
|
|
| MCULE-2420758748 |
0.61 |
O=C1C2CC(C3CC=CC23)C1
|
|
| MCULE-5281461360 |
0.61 |
C1(=O)C=CCCCC1
|
|
| MCULE-8149754044 |
0.61 |
C(C1=CC(C)CCC1)=O
|
|
| MCULE-3524678284 |
0.61 |
C1C[C@@]2(CC[C@@H](C(C(=O)O)=C)CC2C([C@@H]1O)=C)C
|
|
| MCULE-6557253058 |
0.61 |
Cl/C(/Cl)=C/CC1C(=O)CCCCC1
|
|
| MCULE-2354192149 |
0.61 |
O=C(C12CCCC1C2)CC1CC=CCC1
|
|
| MCULE-5466118884 |
0.61 |
C1C(CCCCC=1C)=O
|
|
| MCULE-7628079142 |
0.61 |
O=C(C1C2C1CCC2)CC1CC=CCC1
|
|
| MCULE-6370581589 |
0.61 |
CC=CC(CC1C2C=CC(CC2)C1)=O
|
|
| MCULE-5368790248 |
0.61 |
C(O)(=O)[C@]12CC[C@@H](C(=C)C)[C@]1([H])[C@]1([H])[C@@]([C@]3([C@@](CC1)([H])[C@]1(C)[C@@](C([C@H](CC1)O)(C)C)([H])CC3)C)(C)CC2
|
|
| MCULE-2275715129 |
0.61 |
C12(C)CCC3(C(C(C(C)=C)CC3)C1CCC1C2(C)CCC2C1(C)CCC(O)C2(C)C)C(O)=O
|
|
| MCULE-9144875166 |
0.61 |
FC1(C2C1CC(C(CC=C)=O)C2)F
|
|
| MCULE-5164796911 |
0.61 |
Cl/C(/Cl)=C/CC1(C=O)CCCC1
|
|
| MCULE-7819289735 |
0.61 |
C1(CCCC(C)=C1C=O)(C)C
|
|
| MCULE-7561172842 |
0.61 |
C1=CC2C3C4C(C(C(=O)C)C13)C=CC4C2C(=O)C
|
|
| MCULE-2125200193 |
0.61 |
[C@@]12(C)CC[C@]3([C@]([H])([C@H](C(C)=C)CC3)[C@@]1([H])CC[C@]1([H])[C@@]3([C@]([H])(C(C)(C)[C@H](CC3)O)CC[C@@]21C)C)C(O)=O
|
|
| MCULE-6577061398 |
0.61 |
Cl/C(/Cl)=C/CC1C(=O)CCC1
|
|
| MCULE-3515431005 |
0.61 |
O=C(C1CCCC1)CC1CC2C(C2)CC1
|
|
| MCULE-9663908186 |
0.61 |
O=CC1(CCCC1)CC1CC2C(C2)CC1
|
|
| MCULE-8184573922 |
0.61 |
O=C1C2C3CC4C2C(=O)CC4C3C1
|
|
| MCULE-1412419550 |
0.61 |
O=C(C12CCCC1C2)C1CCCCCC1
|
|
| MCULE-1715062527 |
0.61 |
C12C3C(=O)CC1CC1CC(=O)C3C21
|
|
| MCULE-2582307480 |
0.61 |
C12CC(CC1=O)CCC2=O
|
|
| MCULE-3156569025 |
0.61 |
C12C3CC4C5C(C=C)(C53)C1C42
|
|
| MCULE-6576132205 |
0.61 |
C1CC23CC2(CC1=O)CCC1C3CC[C@]2(C)C(=O)CCC12
|
|
| MCULE-7212683885 |
0.61 |
O=C(C1CC2C(C2)CC1)CC1CCCC1
|
|
| MCULE-6029212888 |
0.61 |
O=C1C(CC2CC3C(C3)C2)CCCCC1
|
|
| MCULE-7821713641 |
0.61 |
O=C1C2C3CCC(C3C2CC1)=O
|
|
| MCULE-5084149997 |
0.61 |
C12(C)CC3C(=O)C1(C)CCC23
|
|
| MCULE-1407965963 |
0.61 |
O=C1C(CC2CC3C(C3)CC2)CCC1
|
|
| MCULE-5946345289 |
0.61 |
C12CC3C4C1C1(C=C)C2C3C41
|
|
| MCULE-4909275031 |
0.61 |
C12C3C4C5C1C1C6C5C5C4C(C(C1C2)C5C6=O)C3=O
|
|
| MCULE-4332194887 |
0.61 |
O=C(C1CC2C(C2)CC1)C1CCCC1
|
|
| MCULE-9914412944 |
0.61 |
O=C1C2C3C4C5C(C3)C1C5C2C4
|
|
| MCULE-1016107980 |
0.61 |
C12(C)C3C4C5C6C(C(=O)C7(CCCC76)C15)(C)C4C1(C2=O)CCCC31
|
|
| MCULE-8088844340 |
0.61 |
C12C3C4C1C1C(=O)C4C4C1C2C34
|
|
| MCULE-8558670984 |
0.61 |
C1(=O)C2CCC1CC(=O)C2
|
|
| MCULE-5042585182 |
0.61 |
O=C(C1C2C(C2)CCC1)CC1CCCC1
|
|
| MCULE-4493133608 |
0.61 |
C12C3CCC4C(C(=O)C1C43)C2
|
|
| MCULE-6274105436 |
0.61 |
O=C1C2C3CC(C2C1)CC3
|
|
| MCULE-1888392770 |
0.61 |
C12C3C(=O)C4C5C(C1C42)C53
|
|
| MCULE-6056390236 |
0.61 |
O=C(C12CCCCC1C2)CC1CCCC1
|
|
| MCULE-4414424892 |
0.61 |
O=C(C1C2C(C2)CCC1)C1CCCC1
|
|
| MCULE-5323101528 |
0.61 |
O=C(C1CCCCCC1)[C@H]1C[C@@H]2[C@@H](C2)C1
|
|
| MCULE-3945470935 |
0.61 |
CC1C(C(CC2CC=CC2)=O)C1
|
|
| MCULE-3600108582 |
0.61 |
CC1CC(C(CC2CC=CC2)=O)C1
|
|
| MCULE-9162899306 |
0.61 |
CC1(C(CC2CC=CC2)=O)CC1
|
|
| MCULE-1960015964 |
0.61 |
O=C(C1CCC1)CC1CC=CC1
|
|
| MCULE-8591003562 |
0.61 |
O=C(C1CC1)CC1CC=CC1
|
|
| MCULE-7546521705 |
0.61 |
C1(/CCC(C/1)C=O)=C(\C)/C
|
|
| MCULE-4126828958 |
0.61 |
CC1(C(C)(C)C1C(CC1CC=CC1)=O)C
|
|
| MCULE-4937917272 |
0.61 |
CC1(C(C(CC2CC=CC2)=O)C1)C
|
|
| MCULE-5300332080 |
0.61 |
O=C(C1CCCCCC=1)[C@H]1C[C@@H]2[C@@H](C2)C1
|
|
| MCULE-9795083418 |
0.61 |
O=C1CC[C@@]2([C@]3(CC[C@@]4(/C(=C/C)/C(=O)C[C@@]4([H])[C@]3([H])CCC2=C1)C)[H])C
|
|
| MCULE-1373086617 |
0.61 |
O=C(C1CCCC=1)[C@H]1C[C@@H]2[C@@H](C2)C1
|
|
| MCULE-3893717167 |
0.61 |
[C@]12(C)CCC3C(CCC4=CC(=O)CC[C@]34C)C1C[C@@H](CC)C2C(C)=O
|
|
| MCULE-9468460485 |
0.61 |
C/C(/C)=C/C(CC1C(N)CCC1)=O
|
|
| MCULE-1428417742 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])C[C@@H](C)[C@]2(C)C(C)=O)[H]
|
|
| MCULE-8417547529 |
0.61 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(C)=O
|
|
| MCULE-5238788396 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2C(C)=O)[H]
|
|
| MCULE-4303966960 |
0.61 |
C[C@@]12[C@H]3CC[C@]4(C)C(=O)CC[C@H]4[C@@H]3CCC1=CC(=O)CC2
|
|
| MCULE-1284522477 |
0.61 |
C12C3C4C=CC1C(C4C(=O)C3)C(=O)C2
|
|
| MCULE-1020785874 |
0.61 |
O=C(C12CCCC1C2)C1CCCCCC=1
|
|
| MCULE-5119094209 |
0.61 |
O=C(C12CCCC1C2)C1CCCCC=1
|
|
| MCULE-7221367574 |
0.61 |
O=C(C12CCCC1C2)C1CCCC=1
|
|
| MCULE-7132823730 |
0.61 |
[C@]12(C)CC[C@]3([C@@]([H])(CCC4=CC(=O)CC[C@]34C)[C@]1([H])CC[C@@H]2[C@H](C)CCCC(C)C)[H]
|
|
| MCULE-3386101177 |
0.61 |
[C@]12(C)CCC3[C@@]([H])(CCC4=CC(=O)CC[C@]34C)C1CC[C@@H]2[C@H](C)/C=C/C(CC)C(C)C
|
|
| MCULE-2012587344 |
0.61 |
C1=CC2C3C4C5C(C(=O)C(=O)C2C4C=C5)C13
|
|
| MCULE-1731235356 |
0.61 |
O=C(C1CCCCC=1)C1C2C(C2)CCC1
|
|
| MCULE-5633538128 |
0.61 |
C12CCCC1(C)CC(=O)C=2C
|
|
| MCULE-8841120984 |
0.61 |
CC(CCC[C@H]([C@@H]1[C@]2(C)[C@@]([C@]3([C@@](CC2)([H])[C@]2(C)C(=CC(=O)CC2)CC3)[H])([H])CC1)C)C
|
|
| MCULE-6340945460 |
0.61 |
O=C(C12CCCCC1C2)C1CCCCC=1
|
|
| MCULE-6739386631 |
0.61 |
O=C(C1CCCCC=1)C1CC2C(C2)CC1
|
|
| MCULE-3209954130 |
0.61 |
C1[C@@H](CC[C@]2(CC[C@H](O)[C@]21C(=O)C)C)C(C(O)=O)=C
|
|
| MCULE-8316425336 |
0.61 |
O=C(C12CCCCC1C2)C1CCCC=1
|
|
| MCULE-2160116138 |
0.61 |
O=C(C1CCCCC=1)[C@@H]1C[C@@H]2C[C@@H]2C1
|
|
| MCULE-3132312011 |
0.61 |
O=C1C=CC2(C)C3CCC4(C)CCCC4C3CCC2(C1)[H]
|
|
| MCULE-3125023758 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@@]4([C@@H]([C@H](C)/C=C/[C@@H](CC)C(C)C)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O)C
|
|
| MCULE-8902385122 |
0.61 |
[C@]12(C)CCC(C=C1CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CCC2=O)C)=O
|
|
| MCULE-8286076650 |
0.61 |
C1(CCCCCC1=O)=CN(C)C
|
|
| MCULE-3585111676 |
0.61 |
C/C(/C)=C/C(C[C@H]1[C@H](N)CCC1)=O
|
|
| MCULE-2754957448 |
0.61 |
O=C(C1CCCC=1)C1C2C(C2)CCC1
|
|
| MCULE-2014220888 |
0.61 |
O=C1C=CCC2(CCC3C4CCC(C4(C)CCC3C21C)=O)[H]
|
|
| MCULE-3526435182 |
0.61 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CC(C)C2(C)C(C)=O
|
|
| MCULE-7384114075 |
0.61 |
C12(C)CCC(C=C1CCC1C2CCC2(C1CCC2=O)C)=O
|
|
| MCULE-3175746942 |
0.61 |
C12(C)C(=O)C=CC(CC1)C2(C)C
|
|
| MCULE-4324141268 |
0.61 |
[C@]12(C)CCC3[C@@]([H])(CC(C4=CC(=O)CC[C@]34C)C)C1CC1CCCCC21C(C)=O
|
|
| MCULE-6041020600 |
0.61 |
C12C(=O)C=CC(C1)CC2
|
|
| MCULE-7458844213 |
0.61 |
O=C(C1CCCC=1)C1CC2C(C2)CC1
|
|
| MCULE-8777632906 |
0.61 |
O=C(C1CCCC=1)CC1CC2C(C2)C1
|
|
| MCULE-4876387221 |
0.61 |
O=C(C1CCCCC=1)CC1CC2C(C2)C1
|
|
| MCULE-9661302470 |
0.61 |
C12(C)CCC3C(CCC4=CC(=O)CCC34C)C1CCC2C(C)CCCC(C)C
|
|
| MCULE-6538426298 |
0.61 |
O=C1CCC2(C)C3CCC4(C)C(CCCCC(C)C)CCC4C3CCC2=C1
|
|
| MCULE-3425686308 |
0.61 |
C1C[C@]2(C)[C@@]3([H])CC[C@]4(C)[C@@]([H])(C(C)=O)CC[C@@]4([H])[C@]3([H])CCC2=CC1=O
|
|
| MCULE-5865441641 |
0.61 |
O=C(C1CCCC=1)CC1CC2C(C2)CC1
|
|
| MCULE-7380885765 |
0.61 |
O=C1CCC2(C3CCC4(C)CCCC4C3CCC2=C1)[H]
|
|
| MolPort-000-451-610 |
0.61 |
CC12CC3C1CCC2(C)C3=O
|
|
| MolPort-046-791-614 |
0.61 |
O=CC1CC2CC1C1CC21
|
|
| MolPort-023-244-234 |
0.61 |
O=C1CC2C1C1CCC2C1
|
|
| MolPort-046-767-200 |
0.61 |
O=C1C[C@@H]2C[C@H]1[C@H]1C[C@@H]21
|
|
| MolPort-003-906-436 |
0.61 |
O=C1CC2C3CC(=O)C4C3CC2C14
|
|
| MolPort-009-014-375 |
0.61 |
C[C@]12CCC3C(CCC45CC34CCC(=O)C5)C1CCC2=O
|
|
| MolPort-001-816-135 |
0.61 |
O=C1C2C3CC4C5CC(C2C35)C14
|
|
| MolPort-046-674-686 |
0.61 |
O=C1C2CC2C2CC12
|
|
| MolPort-046-069-932 |
0.61 |
CC(C)=C1CCC(=O)CC1
|
|
| MolPort-003-930-815 |
0.61 |
OC(=O)CCCCC=C
|
|
| MolPort-002-526-176 |
0.61 |
CC(C)[C@H](C)\C=C\[C@@H](C)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-002-517-271 |
0.61 |
C[C@]12CCC3C(CCC4=CC(=O)CCC34)C1CCC2=O
|
|
| MolPort-046-596-417 |
0.61 |
CC1CC2C3CC4CCCCC4(C(C)=O)[C@@]3(C)CCC2[C@@]2(C)CCC(=O)C=C12
|
|
| MolPort-002-524-345 |
0.61 |
CC(C)CCC[C@@H](C)[C@H]1CCC2[C@@H]3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]12C
|
|
| MolPort-035-706-382 |
0.61 |
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)C=CC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
|
|
| MolPort-046-690-449 |
0.61 |
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CCC2=C
|
|
| MolPort-003-847-259 |
0.61 |
CC[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CCC2=O
|
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| MolPort-001-740-812 |
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CC[C@@H]1CC2C3CCC4=CC(=O)CC[C@]4(C)C3CC[C@]2(C)C1C(C)=O
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CC(C)CCCC(C)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C
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CC(C(CC1C2C=CC(CC2)C1)=O)(C)C
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|
