0 B8R1.1 CCc1cnc([nH]1)C Molport-036-201-867 [0,1,0,0,0,0|1,0,0]=2 1 B8R1.1 CCc1nc(c[nH]1)C Molport-000-141-380 [0,1,0,0,0,0|1,0,1]=3 2 B8R1.1 CCc1ncc([nH]1)C Molport-016-891-219 [0,1,0,0,0,0|1,0,0]=2 3 B8R1.1 CCn1cnc(c1)C Molport-039-049-983 [0,1,0,0,0,0|2,0,0]=3 4 B8R1.18 Cc1c[n+](cn1C)C Molport-047-632-407 [0,1,0,0,0,0|2,0,1]=4 5 B8R1.18 Cc1nc(c([nH]1)C)C Molport-003-811-796 [0,1,0,0,0,0|1,0,0]=2 6 B8R1.18 Cc1nc(c([nH]1)C)C Molport-044-422-934 [0,1,0,0,0,0|1,0,0]=2 7 B8R1.50 Cc1cnc(n1C)C Molport-047-606-559 [0,1,0,0,0,0|1,0,0]=2 8 B8R1.50 Cc1csc([n+]1C)C Molport-001-763-609 [0,1,0,0,0,0|2,0,0]=3 9 B8R1.50 Cc1ncn(c1C)C Molport-021-875-049 [0,1,0,0,0,0|2,0,0]=3 10 B8R1.50 Cc1sc[n+](c1C)C Molport-002-486-977 [0,1,0,0,0,0|3,0,0]=4 11 B9R1.7 CCCc1c[nH]c(=N)s1 Molport-028-751-523 [0,2,0,0,0,0|1,0,1]=4 12 B9R1.7 CCCc1nc(c[nH]1)C Molport-000-004-935 [0,2,0,0,0,0|1,0,1]=4 13 B9R1.7 CCCc1ncc(s1)N Molport-004-812-637 [0,2,0,0,0,0|1,0,0]=3 14 B9R1.7 CCCc1ncc(s1)N Molport-046-148-567 [0,2,0,0,0,0|1,0,0]=3 15 B9R1.7 CCOc1cnc(s1)C Molport-004-812-754 [0,2,0,0,0,0|0,0,0]=2 16 B9R1.7 CNCc1cn(cn1)C Molport-022-146-849 [0,2,0,0,0,0|2,0,0]=4 17 B9R1.7 CNCc1nc(c[nH]1)C Molport-001-794-984 [0,2,0,0,0,0|1,0,1]=4 18 B9R1.7 CNCc1nc(c[nH]1)C Molport-029-998-235 [0,2,0,0,0,0|1,0,1]=4 19 B9R1.7 COCc1cn(cn1)C Molport-038-267-020 [0,2,0,0,0,0|2,0,0]=4 20 B9R1.7 Cc1c[nH]c(n1)CCN Molport-001-794-860 [0,2,0,0,0,0|1,0,1]=4 21 B9R1.7 Cc1c[nH]c(n1)CCN Molport-016-575-254 [0,2,0,0,0,0|1,0,1]=4 22 B9R1.7 Cc1cnc([nH]1)CCN Molport-049-232-304 [0,2,0,0,0,0|1,0,0]=3 23 B9R1.7 Cc1cnc(s1)CCN Molport-002-683-134 [0,2,0,0,0,0|0,0,0]=2 24 B9R1.7 Cc1cnc(s1)CCN Molport-019-931-262 [0,2,0,0,0,0|0,0,0]=2 25 B9R1.7 Cc1nc(c[nH]1)CCN Molport-016-899-695 [0,2,0,0,0,0|1,0,1]=4 26 B9R1.7 Cc1nc(c[nH]1)CCO Molport-047-913-693 [0,2,0,0,0,0|1,0,1]=4 27 B9R1.7 Cc1ncc(s1)CCN Molport-014-954-211 [0,2,0,0,0,0|0,0,0]=2 28 B9R1.7 Cc1ncc(s1)CCN Molport-046-071-567 [0,2,0,0,0,0|0,0,0]=2 29 B9R1.7 Cc1ncc(s1)CCO Molport-020-248-493 [0,2,0,0,0,0|0,0,0]=2 30 B9R1.7 Cn1cnc(c1)CCN Molport-003-958-757 [0,2,0,0,0,0|2,0,0]=4 31 B9R1.7 Cn1cnc(c1)CCN Molport-004-946-867 [0,2,0,0,0,0|2,0,0]=4 32 B9R1.7 Cn1cnc(c1)CCN Molport-006-803-985 [0,2,0,0,0,0|2,0,0]=4 33 B9R1.7 Cn1cnc(c1)CCN Molport-051-776-635 [0,2,0,0,0,0|2,0,0]=4 34 B9R1.7 Cn1cnc(c1)CCO Molport-029-503-122 [0,2,0,0,0,0|2,0,0]=4 35 B9R1.21 CCc1c[nH]c(n1)CN Molport-044-511-892 [0,2,0,0,0,0|1,0,1]=4 36 B9R1.21 CCc1c[nH]c(n1)CO Molport-042-623-070 [0,2,0,0,0,0|1,0,1]=4 37 B9R1.21 CCc1cnc(s1)CO Molport-013-468-292 [0,2,0,0,0,0|0,0,0]=2 38 B9R1.21 CCc1csc(n1)CO Molport-013-468-288 [0,2,0,0,0,0|2,0,0]=4 39 B9R1.21 CCc1nc(c[nH]1)CN Molport-044-586-605 [0,2,0,0,0,0|1,0,1]=4 40 B9R1.21 CCc1ncc([nH]1)CO Molport-000-003-600 [0,2,0,0,0,0|1,0,0]=3 41 B9R1.21 CCn1cnc(c1)CN Molport-022-520-572 [0,2,0,0,0,0|2,0,0]=4 42 B9R1.21 CCn1cnc(c1)CN Molport-046-782-594 [0,2,0,0,0,0|2,0,0]=4 43 B9R1.21 CCn1cnc(c1)CO Molport-004-774-968 [0,2,0,0,0,0|2,0,0]=4 44 B9R1.22 CCc1nc([nH]c1C)C Molport-047-607-869 [0,2,0,0,0,0|1,0,0]=3 45 B9R1.22 CCc1sc(=S)[nH]c1C Molport-005-980-545 [0,2,0,0,0,0|1,0,1]=4 46 B9R1.22 Cc1cn(c(n1)CO)C Molport-038-262-175 [0,2,0,0,0,0|1,0,1]=4 47 B9R1.22 Cc1nc(c([nH]1)C)CN Molport-044-591-528 [0,2,0,0,0,0|1,0,0]=3 48 B9R1.22 Cc1nc(c([nH]1)C)CO Molport-029-279-079 [0,2,0,0,0,0|1,0,0]=3 49 B9R1.22 Cc1nc(c(s1)C)CO Molport-004-812-541 [0,2,0,0,0,0|0,0,0]=2 50 B9R1.22 Cc1nc(c(s1)CO)C Molport-000-142-304 [0,2,0,0,0,0|0,0,0]=2 51 B9R1.23 Cc1nc([nH]c1C)CN Molport-023-198-190 [0,2,0,0,0,0|1,0,0]=3 52 B9R1.23 Cc1nc([nH]c1C)CO Molport-006-830-765 [0,2,0,0,0,0|1,0,0]=3 53 B9R1.23 Cc1nc(cn1C)CO Molport-029-279-080 [0,2,0,0,0,0|1,0,1]=4 54 B9R1.23 Cc1nc(sc1C)CO Molport-006-830-788 [0,2,0,0,0,0|0,0,0]=2 55 B9R1.23 Cc1nc(sc1C)CO Molport-029-997-690 [0,2,0,0,0,0|0,0,0]=2 56 B9R1.35 CC(C)c1c[nH]c(=N)s1 Molport-020-090-388 [0,2,0,0,0,0|1,0,1]=4 57 B9R1.35 CC(C)c1cn(cn1)C Molport-004-774-797 [0,2,0,0,0,0|2,0,0]=4 58 B9R1.35 CC(C)c1cnc([nH]1)N Molport-029-459-872 [0,2,0,0,0,0|2,0,0]=4 59 B9R1.35 CC(C)c1cnc(s1)N Molport-004-812-831 [0,2,0,0,0,0|1,0,0]=3 60 B9R1.35 CC(C)c1nc(c[nH]1)C Molport-039-139-085 [0,2,0,0,0,0|1,0,1]=4 61 B9R1.35 CC(C)c1ncc([nH]1)C Molport-046-939-651 [0,2,0,0,0,0|1,0,0]=3 62 B9R1.35 CC(C)c1ncc(s1)N Molport-004-812-618 [0,2,0,0,0,0|1,0,0]=3 63 B9R1.35 CC(N)c1cn(cn1)C Molport-046-688-100 [0,2,0,0,0,0|2,0,0]=4 64 B9R1.35 CC(N)c1cn(cn1)C Molport-047-589-873 [0,2,0,0,0,0|2,0,0]=4 65 B9R1.35 CC(N)c1cnc(s1)C Molport-003-756-945 [0,2,0,0,0,0|0,0,0]=2 66 B9R1.35 CC(N)c1csc(n1)C Molport-001-794-980 [0,2,0,0,0,0|2,0,0]=4 67 B9R1.35 CC(N)c1csc(n1)C Molport-008-383-010 [0,2,0,0,0,0|2,0,0]=4 68 B9R1.35 CC(N)c1nc(c[nH]1)C Molport-016-631-629 [0,2,0,0,0,0|1,0,1]=4 69 B9R1.35 CC(N)c1nc(c[nH]1)C Molport-029-998-236 [0,2,0,0,0,0|1,0,1]=4 70 B9R1.35 CC(N)c1nc(c[nH]1)C Molport-038-935-715 [0,2,0,0,0,0|1,0,1]=4 71 B9R1.35 CC(N)c1ncc(s1)C Molport-003-752-508 [0,2,0,0,0,0|0,0,0]=2 72 B9R1.35 CC(N)c1ncc(s1)C Molport-019-931-251 [0,2,0,0,0,0|0,0,0]=2 73 B9R1.35 CC(O)c1cn(cn1)C Molport-021-802-740 [0,2,0,0,0,0|2,0,0]=4 74 B9R1.35 CC(O)c1nc(cs1)C Molport-006-831-277 [0,2,0,0,0,0|2,0,0]=4 75 B9R1.35 CC(O)c1ncc(s1)C Molport-006-831-278 [0,2,0,0,0,0|0,0,0]=2 76 B9R1.35 C[C@@H](O)c1csc(n1)C Molport-011-138-827 [0,2,0,0,0,0|2,0,0]=4 77 B9R1.35 C[C@H](N)c1csc(n1)C Molport-027-713-895 [0,2,0,0,0,0|2,0,0]=4 78 B9R1.35 C[C@H](O)c1csc(n1)C Molport-011-138-828 [0,2,0,0,0,0|2,0,0]=4 79 B9R1.132 Cc1c(ncn1C)CN Molport-029-279-071 [0,2,0,0,0,0|2,0,0]=4 80 B9R1.132 Cc1c(ncn1C)CO Molport-029-001-479 [0,2,0,0,0,0|2,0,0]=4 81 B9R1.132 Cc1cnc(n1C)CO Molport-004-774-937 [0,2,0,0,0,0|1,0,0]=3 82 B9R1.132 Cc1ncc(n1C)CN Molport-006-831-345 [0,2,0,0,0,0|1,0,0]=3 83 B9R1.132 Cc1ncc(n1C)CN Molport-019-931-300 [0,2,0,0,0,0|1,0,0]=3 84 B9R1.132 Cc1ncc(n1C)CO Molport-018-553-144 [0,2,0,0,0,0|1,0,0]=3 85 B9R1.37 Cc1nc(n(c1C)C)C Molport-006-113-614 [0,2,0,0,0,0|1,0,0]=3 86 B9R1.37 Cc1nc(n(c1C)C)N Molport-046-688-224 [0,2,0,0,0,0|2,0,0]=4 87 B9R1.37 Cc1nc(n(c1C)C)S Molport-028-916-285 [0,2,0,0,0,0|2,0,0]=4 88 B9R1.37 Cc1nc(n(c1N)C)C Molport-051-784-355 [0,2,0,0,0,0|1,0,1]=4