0 B9R1.3 CC1NCCN(C1=O)C Molport-028-935-412 [1,0,0,0,0,0|2,0,0]=3 1 B9R1.40 CC1(NCCOC1=O)C Molport-003-786-067 [1,0,0,0,0,0|2,0,0]=3 2 B9R1.40 O=C1NCCCC1(F)F Molport-029-078-338 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.66 CC1(CC(CCO1)N)C Molport-001-794-972 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.424 CC1=C(C(CCC1)(C)C)CO Molport-003-846-086 [0,1,0,0,0,0|0,0,2]=3 5 B11R1.1070 CN1CCCC(C1=O)(O)CN Molport-029-997-863 [0,1,0,0,0,0|2,0,0]=3 6 B9R0.25 COC(=O)C(=O)C(C)(C)C Molport-006-127-963 [0,0,1,0,0,0|2,0,1]=4 7 B9R0.60 COC(=O)C(C)(C)CCO Molport-029-095-472 [0,0,1,0,0,0|2,0,0]=3 8 B9R1.138 CC1(CCC(C1=O)Br)C Molport-026-972-098 [0,0,0,0,1,0|1,0,0]=2 9 B8R0.28 CC(=O)OCCC(C)C Molport-000-872-035 [1,0,1,0,0,0|1,0,1]=4 10 B8R0.28 CC(C)CNCC(C)C Molport-001-791-365 [1,0,1,0,0,0|1,0,1]=4 11 B8R0.28 CC(C)CNCC(C)O Molport-002-499-012 [1,0,1,0,0,0|1,0,1]=4 12 B8R0.28 CC(C)C[AlH4]CC(C)C Molport-003-927-433 [1,0,1,0,0,0|1,0,1]=4 13 B8R0.2 CCC(Br)C(=O)N(C)C Molport-006-128-028 [1,0,1,0,0,0|2,0,0]=4 14 B8R0.2 CCC(N)C(=O)N(C)C Molport-009-676-981 [1,0,1,0,0,0|2,0,0]=4 15 B8R0.2 CNC(C)C(=O)N(C)C Molport-005-222-595 [1,0,1,0,0,0|2,0,0]=4 16 B8R0.3 CCCC(N)C(=O)NC Molport-009-676-979 [1,0,1,0,0,0|2,0,0]=4 17 B8R0.3 CCCC(N)C(=O)OC Molport-009-676-972 [1,0,1,0,0,0|2,0,0]=4 18 B8R0.3 CCC[C@@H](N)C(=O)OC Molport-044-375-817 [1,0,1,0,0,0|2,0,0]=4 19 B8R0.8 CC(C)C(=O)NCCN Molport-016-636-388 [1,0,1,0,0,0|2,0,0]=4 20 B8R0.8 CC(C)C(=O)NCCO Molport-008-439-240 [1,0,1,0,0,0|2,0,0]=4 21 B8R0.8 CCCNC(=O)C(C)Cl Molport-004-411-947 [1,0,1,0,0,0|2,0,0]=4 22 B8R0.8 CN(C)C(=O)CCCN Molport-016-634-429 [1,0,1,0,0,0|2,0,0]=4 23 B8R0.8 CNCCC(=O)N(C)C Molport-005-909-499 [1,0,1,0,0,0|2,0,0]=4 24 B8R0.25 CCCCC(C)(C)C=O Molport-022-365-531 [1,0,1,0,0,0|0,0,0]=2 25 B8R0.14 CC(C)(C)C(=O)CC#N Molport-000-154-856 [1,0,1,0,0,0|1,0,1]=4 26 B8R0.14 CC(C)(C)C(=O)OCCl Molport-002-501-250 [1,0,1,0,0,0|2,0,0]=4 27 B8R0.14 CCNC(=O)C(C)(C)C Molport-006-712-069 [1,0,1,0,0,0|1,0,0]=3 28 B8R0.14 CCNC(=O)C(C)(C)N Molport-014-594-851 [1,0,1,0,0,0|2,0,0]=4 29 B8R0.14 CCNC(=O)C(C)(C)O Molport-001-817-309 [1,0,1,0,0,0|2,0,0]=4 30 B8R0.14 CCOC(=O)C(C)(C)Br Molport-001-790-561 [1,0,1,0,0,0|2,0,0]=4 31 B8R0.14 CCOC(=O)C(C)(C)N Molport-003-356-004 [1,0,1,0,0,0|2,0,0]=4 32 B8R0.14 CNCC(=O)C(C)(C)C Molport-035-716-170 [1,0,1,0,0,0|1,0,0]=3 33 B8R0.27 CN(C)C(=O)C(C)(C)N Molport-009-676-980 [1,0,1,0,0,0|2,0,0]=4 34 B8R0.13 CCC(C)(N)C(=O)OC Molport-000-148-008 [1,0,1,0,0,0|2,0,0]=4 35 B8R0.13 CCC(C)(N)C(=O)OC Molport-003-981-764 [1,0,1,0,0,0|2,0,0]=4 36 B8R0.13 CCC(C)(N)C(=O)OC Molport-008-326-657 [1,0,1,0,0,0|2,0,0]=4 37 B8R0.13 CNC(=O)C(C)(C)NC Molport-029-997-740 [1,0,1,0,0,0|2,0,0]=4 38 B8R0.12 CC(C)(CCO)C(=O)[O-] Molport-044-189-545 [1,0,1,0,0,0|2,0,0]=4 39 B8R0.12 CCOC(C)(C)C(=O)O Molport-012-844-190 [1,0,1,0,0,0|2,0,0]=4 40 B8R1.4 CC1CCCC(C1)O Molport-001-791-996 [2,0,0,0,0,0|1,0,1]=4 41 B8R1.4 CC1CCCC(N1)C Molport-002-324-351 [2,0,0,0,0,0|1,0,0]=3 42 B8R1.4 CC1CCNC(C1)C Molport-000-887-472 [2,0,0,0,0,0|1,0,1]=4 43 B8R1.4 CC1CNCC(C1)C Molport-001-791-757 [2,0,0,0,0,0|1,0,1]=4 44 B8R1.4 CC1CNCC(O1)C Molport-001-794-167 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.4 CC1COCC(N1)C Molport-008-463-683 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.4 C[C@@H]1CCC[C@H](N1)C Molport-035-386-897 [2,0,0,0,0,0|1,0,0]=3 47 B8R1.4 C[C@H]1CCC[C@@H](N1)C Molport-044-192-491 [2,0,0,0,0,0|1,0,0]=3 48 B8R1.4 C[C@H]1CNC[C@H](N1)C Molport-001-768-837 [2,0,0,0,0,0|2,0,0]=4 49 B8R1.5 CC1CCCCC1N Molport-001-001-635 [2,0,0,0,0,0|1,0,1]=4 50 B8R1.5 CC1CCCCC1O Molport-001-759-246 [2,0,0,0,0,0|0,0,2]=4 51 B8R1.5 CC1CCCNC1=O Molport-000-142-100 [2,0,0,0,0,0|1,0,0]=3 52 B8R1.5 CC1NCCNC1=O Molport-000-004-955 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.5 CC1NCCNC1=O Molport-004-847-433 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.5 CN1CCNCC1=O Molport-004-889-518 [2,0,0,0,0,0|2,0,0]=4 55 B8R1.5 N[C@@H]1CCCNC1=O Molport-000-140-494 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.5 O=C1CCCCC1Cl Molport-001-780-300 [2,0,0,0,0,0|1,0,0]=3 57 B8R1.5 O=C1NCCCC1Br Molport-006-126-953 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.5 O=C1NCCCC1O Molport-006-708-370 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.72 CC1(CCCNC1)C Molport-000-124-671 [2,0,0,0,0,0|1,0,1]=4 60 B8R1.72 CC1(CNCCO1)C Molport-005-312-548 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.72 CC1(COCCN1)C Molport-000-003-439 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.72 C[N+]1(CCCCC1)C Molport-003-909-253 [2,0,0,0,0,0|1,0,1]=4 63 B10R0.3 CC(=CCCC(C)NC=O)C Molport-002-510-784 [0,1,1,0,0,0|0,0,2]=4 64 B10R0.60 CCC(C)CCCC(C)(C)O Molport-002-507-360 [0,1,1,0,0,0|1,0,1]=4 65 B10R0.65 CCC(C)(O)CCCC(C)C Molport-003-929-814 [0,1,1,0,0,0|1,0,1]=4 66 B10R0.98 CC(C)CCC[C@H](N)C(=O)O Molport-023-332-999 [0,1,1,0,0,0|1,0,0]=3 67 B10R0.42 CCCCNC(C)(C)P(=O)O Molport-006-122-192 [0,1,1,0,0,0|2,0,0]=4 68 B10R0.9 CCN(CC)C(=O)C(C)(C)N Molport-004-777-413 [0,1,1,0,0,0|2,0,0]=4 69 B10R0.124 C=CCCC(C)(C)C(=O)OC Molport-042-670-831 [0,1,1,0,0,0|1,0,1]=4 70 B10R1.2 CCC1NCCN(C1=O)C Molport-029-997-472 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.22 CC1CC(CC(N1C)C)O Molport-020-248-168 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.22 CC1CN(CC(C1=O)C)C Molport-002-344-149 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.245 CC1CCCC(C1CN)C Molport-025-072-692 [1,1,0,0,0,0|1,0,1]=4 74 B10R1.63 CC1CNC(C(=O)C1)(C)C Molport-002-134-249 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.63 CC1CNC(C(=O)C1)(C)C Molport-002-709-338 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.230 CC1(CCCCC1=O)NO Molport-000-145-760 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.230 CC1(CCCCC1=O)[NH2+][O-] Molport-019-940-264 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.171 CCC1CNCC(N1)(C)C Molport-028-987-745 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.307 CC1(COCC(N1)(C)C)C Molport-001-799-572 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.329 CC1(CC(CC(C1)O)N)C Molport-039-125-853 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.329 CC1CC(=O)CC(C1)(C)C Molport-001-793-291 [1,1,0,0,0,0|0,0,2]=4 82 B10R1.329 CC1CC(CC(C1)(C)C)N Molport-001-791-832 [1,1,0,0,0,0|0,0,1]=3 83 B10R1.329 CC1CC(CC(C1)(C)C)O Molport-000-727-952 [1,1,0,0,0,0|0,0,1]=3 84 B10R1.220 CC1(CCC(C1=O)C#N)C Molport-029-879-076 [0,1,0,0,1,0|0,0,1]=3 85 B12R1.510 CN1C(CC(CC1(C)C)N)(C)C Molport-000-141-470 [0,2,0,0,0,0|2,0,0]=4 86 B12R1.510 CN1C(CC(CC1(C)C)N)(C)C Molport-002-090-698 [0,2,0,0,0,0|2,0,0]=4 87 B12R1.510 CN1C(CC(CC1(C)C)O)(C)C Molport-002-742-962 [0,2,0,0,0,0|2,0,0]=4 88 B10R1.23 CC(Cl)C(=O)N1CCCC1 Molport-004-411-945 [0,0,1,1,0,0|2,0,0]=4 89 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 Molport-029-998-053 [0,0,1,1,0,0|2,0,0]=4 90 B10R1.102 CC(C)(CO)CC1CCC1 Molport-042-670-744 [0,0,1,1,0,0|0,0,2]=4 91 B10R1.315 CC1(C(=O)C(C1=O)(C)C)C Molport-002-501-922 [0,0,1,1,0,0|1,0,1]=4 92 B10R1.411 COC(=O)C1(CCCC1)Br Molport-028-950-387 [0,0,1,1,0,0|2,0,0]=4 93 B10R1.411 COC(=O)C1(CCCN1)C Molport-027-839-246 [0,0,1,1,0,0|2,0,0]=4 94 B10R1.411 COC(=O)[C@@]1(CCCN1)C Molport-030-005-236 [0,0,1,1,0,0|2,0,0]=4 95 B10R2.19 CC12CCC(C1)CC2N Molport-016-583-498 [1,0,0,1,0,0|1,0,1]=4 96 B10R2.534 CC1CNCC2(C1)CC2 Molport-044-375-812 [1,0,0,1,0,0|1,0,1]=4 97 B12R2.509 CC1([C@H]([C@]2(CC[C@@H]1C2)C)O)C Molport-002-506-889 [0,1,0,1,0,0|0,0,2]=4 98 B12R2.509 CC1([C@H]2CC[C@](C2)([C@H]1O)C)C Molport-003-927-521 [0,1,0,1,0,0|0,0,2]=4 99 B12R2.509 CC12CCC(C1)C(C2N)(C)C Molport-000-145-692 [0,1,0,1,0,0|1,0,1]=4 100 B12R2.5294 CC1(CCC2CC1C2(C)C)O Molport-003-855-454 [0,1,0,1,0,0|1,0,1]=4 101 B12R3.4045 CC1(C2CC3C1(C3C2)C)C Molport-006-111-525 [0,0,0,2,0,0|1,0,1]=4 102 B8R1.50 CC1CCC(=O)C1=O Molport-001-766-677 [1,0,0,0,1,0|1,0,1]=4 103 B8R1.50 CC1CCN(C1=O)C Molport-001-758-924 [1,0,0,0,1,0|1,0,0]=3 104 B8R1.50 CN1CCC(C1=O)Br Molport-020-166-587 [1,0,0,0,1,0|2,0,0]=4 105 B8R1.50 CN1CCC(C1=O)N Molport-008-269-603 [1,0,0,0,1,0|2,0,0]=4 106 B8R1.50 CN1CCC(C1=O)O Molport-021-049-842 [1,0,0,0,1,0|2,0,0]=4 107 B8R1.19 CC1(CCCC1N)C Molport-044-755-182 [1,0,0,0,1,0|1,0,1]=4 108 B8R1.19 CC1(CCCC1O)C Molport-006-758-082 [1,0,0,0,1,0|0,0,2]=4 109 B8R1.19 CC1(CCNC1=O)C Molport-009-195-986 [1,0,0,0,1,0|1,0,0]=3 110 B8R1.19 CC1(CCNC1=O)N Molport-022-364-766 [1,0,0,0,1,0|2,0,0]=4 111 B8R1.19 CC1(CCOC1=O)C Molport-009-198-442 [1,0,0,0,1,0|1,0,0]=3 112 B8R1.19 CC1(CONC1=O)C Molport-020-313-574 [1,0,0,0,1,0|2,0,0]=4 113 B8R1.19 CC1(NCCC1=O)C Molport-027-837-709 [1,0,0,0,1,0|1,0,0]=3 114 B8R1.51 CC1(CCC(C1)N)C Molport-027-845-073 [1,0,0,0,1,0|1,0,1]=4 115 B8R1.51 CC1CCC(N1)(C)C Molport-039-240-946 [1,0,0,0,1,0|1,0,0]=3 116 B8R1.51 CC1CNC(C1)(C)C Molport-028-956-652 [1,0,0,0,1,0|1,0,1]=4 117 B10R0.32 CCCC(C)C(=O)NC(C)C Molport-020-325-333 [0,0,1,0,0,1|0,0,0]=2 118 B10R0.37 CCC(Br)C(=O)NC(C)(C)C Molport-002-987-791 [0,0,1,0,0,1|1,0,0]=3 119 B10R0.67 CCC(C)(C)NC(=S)N(C)C Molport-002-917-741 [0,0,1,0,0,1|1,1,0]=4