0 B9R1.6 CC(=O)C1=CN=CN=C1 Molport-004-759-354 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.6 CC(=O)C1=CSCCN1 Molport-004-771-345 [0,0,0,0,0,0|0,0,0]=0 2 B9R1.6 CC(=O)C1CCCCC1 Molport-001-760-909 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.6 CC(=O)C1CCCCN1 Molport-023-332-399 [0,0,0,0,0,0|1,0,2]=3 4 B9R1.6 CC(=O)C1CCCNC1 Molport-001-794-859 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.6 CC(=O)C1CCCNC1 Molport-028-957-632 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.6 CC(N)C1=CCCCC1 Molport-029-997-526 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 NC(=O)C1=CNCCC1 Molport-001-762-904 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 NC(=O)C1CCCCN1 Molport-002-467-271 [0,0,0,0,0,0|2,0,2]=4 9 B9R1.6 NC(=O)C1CCCCN1 Molport-005-310-643 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.6 O=C(O)C1=CCCNC1 Molport-003-179-100 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.6 O=C(O)C1=COCCC1 Molport-016-635-619 [0,0,0,0,0,0|2,1,0]=3 12 B9R1.6 O=C(O)C1=COCCO1 Molport-000-873-350 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.6 O=C(O)C1CNCCN1 Molport-000-141-392 [0,0,0,0,0,0|2,0,2]=4 14 B9R1.6 O=C(O)C1CNCCN1 Molport-001-768-421 [0,0,0,0,0,0|2,0,2]=4 15 B9R1.6 O=C(O)C1CSCCN1 Molport-000-006-313 [0,0,0,0,0,0|1,0,2]=3 16 B9R1.6 O=C(O)[C@@H]1CCCCN1 Molport-002-498-081 [0,0,0,0,0,0|2,0,2]=4 17 B9R1.6 O=C(O)[C@H]1CNCCN1 Molport-000-005-914 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.6 [13CH3]C(=O)C1=CC=CC=C1 Molport-003-929-542 [0,0,0,0,0,0|2,0,2]=4 19 B8R1.2 O=CC1=CCCOC1 Molport-000-133-054 [1,0,0,0,0,0|1,1,1]=4 20 B8R1.2 O=CC1=COCCC1 Molport-000-144-657 [1,0,0,0,0,0|1,1,0]=3 21 B10R1.13 CC(=O)C1=CCN(CC1)C Molport-002-321-319 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.15 CNC(=O)C1CCCCN1 Molport-009-653-618 [0,1,0,0,0,0|1,0,2]=4 23 B10R1.15 COC(=O)C1=CCCCC1 Molport-002-502-008 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.15 COC(=O)C1=CCNCC1 Molport-030-084-360 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.61 CC1=C(CCCO1)C(=O)O Molport-001-768-181 [0,1,0,0,0,0|2,1,0]=4 26 B10R1.61 CC1=C(SCCO1)C(=O)O Molport-007-922-542 [0,1,0,0,0,0|2,1,0]=4 27 B10R1.61 CC1CCCC=C1C(=O)O Molport-039-010-499 [0,1,0,0,0,0|3,0,0]=4 28 B10R1.61 O=C(O)C1=C(CCCC1)Cl Molport-002-471-266 [0,1,0,0,0,0|3,0,0]=4 29 B8R0.7 CCCS/C=C\C(=O)[O-] Molport-005-909-508 [0,0,1,0,0,0|2,0,0]=3 30 B8R0.8 CCCCC(N)C(=O)C Molport-035-716-447 [0,0,1,0,0,0|1,0,2]=4 31 B8R0.8 CCCNC(=O)C(=O)O Molport-006-068-721 [0,0,1,0,0,0|3,0,0]=4 32 B8R0.8 CCSC[C@H](N)C(=O)O Molport-003-909-573 [0,0,1,0,0,0|1,0,2]=4 33 B8R1.7 CC(=O)C1=CN=CS1 Molport-002-499-373 [0,0,0,0,1,0|2,0,1]=4 34 B8R1.7 CC(=O)C1=COC=C1 Molport-002-883-068 [0,0,0,0,1,0|0,1,2]=4 35 B8R1.7 CC(=O)C1CCNC1 Molport-028-600-513 [0,0,0,0,1,0|1,0,2]=4 36 B8R1.7 NC(=O)C1=CC=CN1 Molport-001-758-788 [0,0,0,0,1,0|1,0,2]=4 37 B8R1.7 NC(=O)C1=CSC=C1 Molport-003-935-692 [0,0,0,0,1,0|1,0,2]=4 38 B8R1.7 NC(=O)C1=CSC=N1 Molport-006-715-310 [0,0,0,0,1,0|1,0,2]=4 39 B8R1.7 NC(=O)C1=CSN=N1 Molport-003-698-942 [0,0,0,0,1,0|2,0,1]=4 40 B8R1.7 NC(=O)C1=NCCN1 Molport-000-003-238 [0,0,0,0,1,0|2,0,0]=3 41 B8R1.7 NC(=O)C1CCCN1 Molport-002-465-320 [0,0,0,0,1,0|1,0,2]=4 42 B8R1.7 NC(=O)C1CCCN1 Molport-004-946-899 [0,0,0,0,1,0|1,0,2]=4 43 B8R1.7 O=C(Cl)C1=CSN=N1 Molport-002-027-431 [0,0,0,0,1,0|2,0,1]=4 44 B8R1.7 O=C(O)C1=CC=NN1 Molport-053-088-300 [0,0,0,0,1,0|2,0,1]=4 45 B8R1.7 O=C(O)C1=CSC=N1 Molport-004-968-019 [0,0,0,0,1,0|1,0,2]=4 46 B8R1.7 O=C(O)C1C=CCN1 Molport-001-769-493 [0,0,0,0,1,0|1,0,2]=4 47 B8R1.7 O=C(O)C1CCCN1 Molport-027-837-861 [0,0,0,0,1,0|1,0,2]=4 48 B8R1.7 O=C(O)C1CCCS1 Molport-021-746-238 [0,0,0,0,1,0|2,0,1]=4 49 B8R1.7 O=C(O)C1SCCS1 Molport-004-768-996 [0,0,0,0,1,0|2,0,1]=4 50 B8R1.7 O=C([O-])C1CSCN1 Molport-006-107-116 [0,0,0,0,1,0|1,0,2]=4 51 B7R0.4 CC(=O)NCCC#N Molport-006-672-824 [1,0,1,0,0,0|2,0,0]=4 52 B7R0.4 CC(=O)NCCCN Molport-004-356-170 [1,0,1,0,0,0|1,0,1]=4 53 B7R0.4 CC(=O)NCCCO Molport-001-765-309 [1,0,1,0,0,0|2,0,0]=4 54 B7R0.4 CC(=O)NCCON Molport-008-545-477 [1,0,1,0,0,0|1,1,0]=4 55 B7R0.4 CCC/C=C\C(=O)O Molport-005-909-359 [1,0,1,0,0,0|2,0,0]=4 56 B7R0.4 CSCCNC(=O)C Molport-002-131-908 [1,0,1,0,0,0|0,0,1]=3 57 B7R0.4 NCCSCC(=O)O Molport-023-137-056 [1,0,1,0,0,0|1,0,1]=4 58 B7R0.5 CCNC(=O)C(=O)O Molport-012-651-515 [1,0,1,0,0,0|1,1,0]=4 59 B7R1.3 O=C1C=CCCO1 Molport-003-928-797 [2,0,0,0,0,0|2,0,0]=4 60 B7R1.3 O=C1CSCCN1 Molport-000-421-998 [2,0,0,0,0,0|0,0,1]=3 61 B9R0.29 CS/C(=C(\C#N)/C(=O)C)/N Molport-000-144-241 [0,1,1,0,0,0|2,0,0]=4 62 B9R1.15 O=CC1=C(CCCC1)Br Molport-022-376-663 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.11 CCC(=O)C1=CC=CN1 Molport-001-780-739 [0,1,0,0,1,0|0,0,2]=4 64 B9R1.11 CNC(=O)C1=CC=NN1 Molport-035-870-449 [0,1,0,0,1,0|1,0,1]=4 65 B9R1.11 CNC(=O)[C@@H]1CCCN1 Molport-009-653-480 [0,1,0,0,1,0|0,0,2]=4 66 B9R1.11 CNC(=O)[C@@H]1CCCN1 Molport-020-004-550 [0,1,0,0,1,0|0,0,2]=4 67 B9R1.11 CNC(=O)[C@H]1CCCN1 Molport-029-998-167 [0,1,0,0,1,0|0,0,2]=4 68 B9R1.11 COC(=O)C1=CCCC1 Molport-002-041-371 [0,1,0,0,1,0|1,0,0]=3 69 B9R1.11 COC(=O)C1=CN=CN1 Molport-002-045-614 [0,1,0,0,1,0|1,0,1]=4 70 B9R1.11 COC(=O)C1=CSN=N1 Molport-002-472-873 [0,1,0,0,1,0|1,0,1]=4 71 B9R1.11 COC(=O)C1C=CCN1 Molport-003-941-091 [0,1,0,0,1,0|0,0,2]=4 72 B9R1.11 COC(=O)C1CCCN1 Molport-001-760-766 [0,1,0,0,1,0|0,0,2]=4 73 B9R1.11 COC(=O)C1CCCN1 Molport-002-780-203 [0,1,0,0,1,0|0,0,2]=4 74 B9R1.11 O=C(CBr)C1=CSC=C1 Molport-000-142-472 [0,1,0,0,1,0|0,0,2]=4 75 B9R1.11 O=C(NO)C1=CCCC1 Molport-046-628-958 [0,1,0,0,1,0|2,0,0]=4 76 B9R1.35 CC(=O)C1=CC(=NN1)C Molport-008-422-913 [0,1,0,0,1,0|1,0,1]=4 77 B9R1.41 CC(=O)C1=CC=NN1C Molport-000-164-708 [0,1,0,0,1,0|1,0,1]=4 78 B9R1.41 CC(=O)C1CCCC1=O Molport-001-790-293 [0,1,0,0,1,0|1,0,1]=4 79 B9R1.41 CC(=O)N1CCOC1=O Molport-003-930-556 [0,1,0,0,1,0|1,1,0]=4 80 B11R1.16 CCOC(=O)C1CSCCN1 Molport-002-499-716 [0,2,0,0,0,0|0,0,2]=4 81 B11R1.23 COC(=O)C1=CC(=O)CCC1 Molport-028-748-704 [0,2,0,0,0,0|2,0,0]=4 82 B11R1.222 COC(=O)C1=C(CCCC1)N Molport-002-893-960 [0,2,0,0,0,0|2,0,0]=4 83 B9R1.7 CC1=CC=C(O1)CCN Molport-003-178-891 [0,0,1,1,0,0|1,0,1]=4 84 B9R1.7 CC1=CC=C(S1)CCN Molport-002-678-875 [0,0,1,1,0,0|1,1,0]=4 85 B9R1.13 O=[N+]([O-])/C=C/1\NCCS1 Molport-002-887-817 [0,0,1,1,0,0|2,0,0]=4 86 B9R1.23 CCN1C=C(C(=N1)C)N Molport-000-848-436 [0,0,1,1,0,0|2,0,0]=4 87 B9R1.23 CCN1C=C(C(=N1)C)N Molport-004-961-048 [0,0,1,1,0,0|2,0,0]=4 88 B11R2.10 O=C1SC2=C(S1)SCCS2 Molport-002-549-208 [0,0,0,1,0,1|2,0,0]=4 89 B7R1.1 CSC1=NCCN1 Molport-000-144-325 [1,0,0,0,1,0|2,0,0]=4 90 B7R1.1 CSC1=NCCN1 Molport-002-480-027 [1,0,0,0,1,0|2,0,0]=4 91 B7R1.1 O=CC1=CN=CN1 Molport-001-791-482 [1,0,0,0,1,0|1,0,1]=4 92 B7R1.1 O=CC1=CSC=C1 Molport-000-998-525 [1,0,0,0,1,0|0,0,2]=4 93 B7R1.1 O=CC1=CSC=N1 Molport-000-139-392 [1,0,0,0,1,0|0,0,2]=4 94 B7R1.1 O=CC1=CSN=N1 Molport-000-146-528 [1,0,0,0,1,0|1,0,1]=4