0 B8R1.8 CCCc1ncc[nH]1 Molport-005-933-441 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.7 CCCc1c[nH]c(=N)s1 Molport-028-751-523 [0,1,0,0,0,0|3,0,0]=4 2 B9R1.7 CCCc1nc(c[nH]1)C Molport-000-004-935 [0,1,0,0,0,0|2,0,0]=3 3 B9R1.7 CCCc1ncc(s1)N Molport-004-812-637 [0,1,0,0,0,0|1,0,0]=2 4 B9R1.7 CCCc1ncc(s1)N Molport-046-148-567 [0,1,0,0,0,0|1,0,0]=2 5 B9R1.7 CCOc1cnc(s1)C Molport-004-812-754 [0,1,0,0,0,0|2,0,0]=3 6 B9R1.7 CNCc1nc(c[nH]1)C Molport-001-794-984 [0,1,0,0,0,0|3,0,0]=4 7 B9R1.7 CNCc1nc(c[nH]1)C Molport-029-998-235 [0,1,0,0,0,0|3,0,0]=4 8 B9R1.7 Cc1c[nH]c(n1)CCN Molport-001-794-860 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.7 Cc1c[nH]c(n1)CCN Molport-016-575-254 [0,1,0,0,0,0|3,0,0]=4 10 B9R1.7 Cc1cnc([nH]1)CCN Molport-049-232-304 [0,1,0,0,0,0|3,0,0]=4 11 B9R1.7 Cc1cnc(s1)CCN Molport-002-683-134 [0,1,0,0,0,0|2,0,0]=3 12 B9R1.7 Cc1cnc(s1)CCN Molport-019-931-262 [0,1,0,0,0,0|2,0,0]=3 13 B9R1.11 CC(CN)c1ncc[nH]1 Molport-046-141-617 [0,1,0,0,0,0|3,0,0]=4 14 B9R1.11 CC(CN)c1nccs1 Molport-003-738-588 [0,1,0,0,0,0|2,0,0]=3 15 B9R1.11 CC(CO)c1ncc[nH]1 Molport-038-942-259 [0,1,0,0,0,0|3,0,0]=4 16 B9R1.11 CCC(C)c1nccs1 Molport-005-940-407 [0,1,0,0,0,0|1,0,0]=2 17 B9R1.11 CCC(N)c1cscn1 Molport-046-851-564 [0,1,0,0,0,0|3,0,0]=4 18 B9R1.11 CCC(N)c1ncc[nH]1 Molport-023-198-662 [0,1,0,0,0,0|2,0,0]=3 19 B9R1.11 CCC(N)c1nccs1 Molport-003-738-242 [0,1,0,0,0,0|1,0,0]=2 20 B9R1.11 CCC(N)c1nccs1 Molport-019-931-296 [0,1,0,0,0,0|1,0,0]=2 21 B9R1.11 CCC(N)c1nccs1 Molport-047-741-579 [0,1,0,0,0,0|1,0,0]=2 22 B9R1.11 CCC(O)c1ncc[nH]1 Molport-027-632-000 [0,1,0,0,0,0|2,0,0]=3 23 B9R1.11 CCC(O)c1nccs1 Molport-004-812-939 [0,1,0,0,0,0|1,0,0]=2 24 B9R1.11 CC[C@H](C)c1nccs1 Molport-051-570-647 [0,1,0,0,0,0|1,0,0]=2 25 B9R1.11 CNC(C)c1nccs1 Molport-004-812-619 [0,1,0,0,0,0|2,0,0]=3 26 B9R1.11 CNC(C)c1nccs1 Molport-047-777-595 [0,1,0,0,0,0|2,0,0]=3 27 B9R1.12 CCCCc1ncc[nH]1 Molport-005-941-725 [0,1,0,0,0,0|2,0,0]=3 28 B9R1.12 CNCCc1c[nH]cn1 Molport-003-983-643 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.12 NCCCc1c[nH]cn1 Molport-044-195-723 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.12 NCCCc1ncc[nH]1 Molport-012-002-715 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.12 NCCCc1ncc[nH]1 Molport-023-334-823 [0,1,0,0,0,0|2,0,0]=3 32 B9R1.12 OCCCc1c[nH]cn1 Molport-028-744-932 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.12 OCCCc1cncs1 Molport-033-482-203 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.12 OCCCc1ncc[nH]1 Molport-046-699-577 [0,1,0,0,0,0|2,0,0]=3 35 B9R1.13 CC(C)Cc1ncc[nH]1 Molport-006-132-360 [0,1,0,0,0,0|2,0,0]=3 36 B9R1.13 CC(C)Sc1c[nH]cn1 Molport-047-593-562 [0,1,0,0,0,0|2,1,0]=4 37 B9R1.13 CC(N)Cc1c[nH]cn1 Molport-022-657-306 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.13 CC(N)Cc1c[nH]cn1 Molport-042-620-575 [0,1,0,0,0,0|3,0,0]=4 39 B9R1.13 CC(O)Cc1ncc[nH]1 Molport-014-002-911 [0,1,0,0,0,0|2,0,0]=3 40 B9R1.13 CC(O)Cc1ncc[nH]1 Molport-023-247-064 [0,1,0,0,0,0|2,0,0]=3 41 B9R1.13 C[C@@H](N)Cc1c[nH]cn1 Molport-003-824-922 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.13 C[C@@H](N)Cc1c[nH]cn1 Molport-003-941-593 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.13 C[C@@H](N)Cc1c[nH]cn1 Molport-039-139-885 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.13 C[C@H](N)Cc1c[nH]cn1 Molport-003-983-622 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.13 C[C@H](N)Cc1c[nH]cn1 Molport-035-936-385 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.13 C[C@H](N)Cc1c[nH]cn1 Molport-047-933-189 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.33 Cn1ccnc1CCO Molport-008-425-853 [0,1,0,0,0,0|3,0,0]=4 48 B9R2.2 C1CC1c2c[nH]cn2 Molport-035-941-949 [0,0,0,1,0,0|3,0,0]=4 49 B9R2.2 C1CC1c2ncc[nH]2 Molport-020-002-238 [0,0,0,1,0,0|2,0,0]=3 50 B9R2.3 C1Cc2c[nH]nc2C1 Molport-015-161-092 [0,0,0,1,0,0|3,0,0]=4 51 B9R2.3 C1Cc2c[nH]nc2C1 Molport-023-222-385 [0,0,0,1,0,0|3,0,0]=4 52 B9R2.3 C1Cc2nc[nH]c2C1 Molport-008-420-805 [0,0,0,1,0,0|3,0,0]=4 53 B9R2.3 C1Cc2nccn2C1 Molport-009-197-061 [0,0,0,1,0,0|2,0,0]=3 54 B8R1.1 CCc1nc(c[nH]1)C Molport-000-141-380 [1,1,0,0,0,0|1,0,0]=3 55 B8R1.1 CCc1ncc([nH]1)C Molport-016-891-219 [1,1,0,0,0,0|1,0,0]=3 56 B8R1.7 CC(C)c1c[nH]cn1 Molport-028-747-057 [1,1,0,0,0,0|2,0,0]=4 57 B8R1.7 CC(C)c1cncs1 Molport-027-835-199 [1,1,0,0,0,0|2,0,0]=4 58 B8R1.7 CC(C)c1ncc[nH]1 Molport-001-791-864 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.4 CCCc1nccnc1C Molport-003-929-062 [0,1,0,0,0,1|2,0,0]=4 60 B10R1.18 CC(C)Cc1cnccn1 Molport-005-935-762 [0,1,0,0,0,1|2,0,0]=4 61 B10R1.14 CC(CN)c1nc(cs1)C Molport-003-738-589 [0,2,0,0,0,0|2,0,0]=4 62 B10R1.14 CC(CN)c1ncc(s1)C Molport-003-752-509 [0,2,0,0,0,0|2,0,0]=4 63 B10R1.14 CCC(N)c1nc(c[nH]1)C Molport-016-631-507 [0,2,0,0,0,0|2,0,0]=4 64 B10R1.14 CCC(N)c1nc(c[nH]1)C Molport-029-997-887 [0,2,0,0,0,0|2,0,0]=4 65 B10R1.14 CCC(N)c1ncc(s1)C Molport-012-088-315 [0,2,0,0,0,0|1,0,0]=3 66 B10R1.14 CCC(N)c1ncc(s1)C Molport-051-783-055 [0,2,0,0,0,0|1,0,0]=3 67 B10R1.16 CNCCc1ncc(s1)C Molport-013-352-322 [0,2,0,0,0,0|1,0,0]=3 68 B10R1.16 CNCCc1ncc(s1)C Molport-051-782-957 [0,2,0,0,0,0|1,0,0]=3 69 B10R1.54 CC(O)Cc1nc(cs1)C Molport-014-797-563 [0,2,0,0,0,0|1,0,0]=3 70 B10R1.96 CCCc1nc(c[nH]1)OC Molport-047-916-514 [0,2,0,0,0,0|2,0,0]=4 71 B10R1.96 CCCc1ncc([nH]1)OC Molport-052-005-984 [0,2,0,0,0,0|2,0,0]=4 72 B10R1.96 CCOc1ncc(s1)CO Molport-004-812-512 [0,2,0,0,0,0|0,0,0]=2 73 B10R1.96 COCc1ncc(s1)CO Molport-022-804-672 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.131 Cc1nc(sc1Cl)CCN Molport-008-382-947 [0,2,0,0,0,0|2,0,0]=4 75 B10R1.6 CCC(C)(N)c1nccs1 Molport-012-805-921 [0,2,0,0,0,0|1,0,0]=3 76 B10R1.6 CCC(C)(N)c1nccs1 Molport-020-167-861 [0,2,0,0,0,0|1,0,0]=3 77 B10R1.11 CCCC(O)c1nccs1 Molport-006-831-247 [0,2,0,0,0,0|1,0,0]=3 78 B10R1.11 CCOC(C)c1ncc[nH]1 Molport-020-096-328 [0,2,0,0,0,0|1,0,0]=3 79 B10R1.11 CNCC(C)c1nccs1 Molport-008-643-964 [0,2,0,0,0,0|1,0,0]=3 80 B10R1.11 COCC(O)c1nccs1 Molport-006-831-257 [0,2,0,0,0,0|1,0,0]=3 81 B10R1.11 N[C@H](CCO)c1nccs1 Molport-051-782-559 [0,2,0,0,0,0|1,0,0]=3 82 B10R1.23 CC(C)C(N)c1ncc[nH]1 Molport-012-002-718 [0,2,0,0,0,0|2,0,0]=4 83 B10R1.23 CC(C)C(N)c1nccs1 Molport-003-738-272 [0,2,0,0,0,0|1,0,0]=3 84 B10R1.23 CC(C)C(O)c1ncc[nH]1 Molport-047-779-850 [0,2,0,0,0,0|2,0,0]=4 85 B10R1.149 CCC(N)c1nccn1C Molport-051-773-825 [0,2,0,0,0,0|2,0,0]=4 86 B10R1.21 NCCCCc1ncc[nH]1 Molport-039-060-520 [0,2,0,0,0,0|2,0,0]=4 87 B10R1.21 OCCCCc1nccs1 Molport-025-891-814 [0,2,0,0,0,0|1,0,0]=3 88 B10R1.27 NC(CO)Cc1nccs1 Molport-044-851-198 [0,2,0,0,0,0|1,0,0]=3 89 B10R1.29 CCOCc1nc[nH]c1C Molport-028-956-728 [0,2,0,0,0,0|2,0,0]=4 90 B10R1.29 Cn1ccnc1CCCN Molport-019-906-297 [0,2,0,0,0,0|2,0,0]=4 91 B10R1.29 Cn1ccnc1CCCN Molport-019-931-346 [0,2,0,0,0,0|2,0,0]=4 92 B10R1.29 Cn1ccnc1CCCO Molport-020-916-119 [0,2,0,0,0,0|2,0,0]=4 93 B10R1.64 CC(N)Cc1nccn1C Molport-006-829-204 [0,2,0,0,0,0|2,0,0]=4 94 B10R2.2 NC1Cc2nccn2C1 Molport-022-470-057 [0,1,0,1,0,0|2,0,0]=4 95 B10R2.2 OC1Cc2nccn2C1 Molport-044-723-599 [0,1,0,1,0,0|2,0,0]=4 96 B10R2.2 O[C@@H]1Cc2nccn2C1 Molport-004-774-795 [0,1,0,1,0,0|2,0,0]=4 97 B10R2.2 O[C@H]1Cc2nccn2C1 Molport-049-224-375 [0,1,0,1,0,0|2,0,0]=4 98 B10R2.14 Nc1cnc(s1)C2CC2 Molport-004-812-494 [0,1,0,1,0,0|1,0,0]=3 99 B10R2.32 NC1CCn2c1ncc2 Molport-004-774-712 [0,1,0,1,0,0|2,0,0]=4 100 B10R2.32 NC1CCn2c1ncc2 Molport-051-815-784 [0,1,0,1,0,0|2,0,0]=4 101 B10R2.32 Nc1cnc2n1CCC2 Molport-047-770-117 [0,1,0,1,0,0|2,0,0]=4 102 B10R2.32 OC1CCn2c1ncc2 Molport-004-774-831 [0,1,0,1,0,0|2,0,0]=4 103 B10R2.32 O[C@@H]1CCn2c1ncc2 Molport-046-591-781 [0,1,0,1,0,0|2,0,0]=4 104 B10R2.32 O[C@H]1CCn2c1ncc2 Molport-047-633-838 [0,1,0,1,0,0|2,0,0]=4 105 B10R2.16 NC1(CC1)c2ncc[nH]2 Molport-046-141-166 [0,1,0,1,0,0|2,0,0]=4 106 B10R2.136 C1CC(C1)c2ncc[nH]2 Molport-035-770-645 [0,1,0,1,0,0|2,0,0]=4 107 B10R2.136 C1NCC1c2ncc[nH]2 Molport-046-201-427 [0,1,0,1,0,0|2,0,0]=4 108 B10R2.136 C1NCC1c2nccs2 Molport-029-997-844 [0,1,0,1,0,0|1,0,0]=3 109 B10R2.136 C1NCC1c2nccs2 Molport-039-028-319 [0,1,0,1,0,0|1,0,0]=3 110 B10R2.21 Cn1ccnc1C2CC2 Molport-051-809-543 [0,1,0,1,0,0|2,0,0]=4