0 B8R1.8 CCCc1ncc[nH]1 Molport-005-933-441 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.7 CCC[n+]1ccn(c1)C Molport-028-617-336 [0,1,0,0,0,0|3,0,0]=4 2 B9R1.7 CCC[n+]1ccn(c1)C Molport-046-682-925 [0,1,0,0,0,0|3,0,0]=4 3 B9R1.7 CCC[n+]1ccn(c1)C Molport-046-934-393 [0,1,0,0,0,0|3,0,0]=4 4 B9R1.7 CCCc1c[nH]c(=N)s1 Molport-028-751-523 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.7 CCCc1c[nH]c(=O)[nH]1 Molport-044-730-173 [0,1,0,0,0,0|3,0,0]=4 6 B9R1.7 CCCn1cc[n+](c1)C Molport-035-759-298 [0,1,0,0,0,0|3,0,0]=4 7 B9R1.7 CCCn1cnc(c1)N Molport-046-142-076 [0,1,0,0,0,0|3,0,0]=4 8 B9R1.7 C[n+]1ccn(c1)CCO Molport-047-353-798 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.7 C[n+]1ccn(c1)CCO Molport-051-861-077 [0,1,0,0,0,0|3,0,0]=4 10 B9R1.7 Cc1c[nH]c(n1)CCN Molport-001-794-860 [0,1,0,0,0,0|3,0,0]=4 11 B9R1.7 Cc1c[nH]c(n1)CCN Molport-016-575-254 [0,1,0,0,0,0|3,0,0]=4 12 B9R1.7 Cc1cnc([nH]1)CCN Molport-049-232-304 [0,1,0,0,0,0|3,0,0]=4 13 B9R1.7 Cc1cnc(s1)CCN Molport-002-683-134 [0,1,0,0,0,0|3,0,0]=4 14 B9R1.7 Cc1cnc(s1)CCN Molport-019-931-262 [0,1,0,0,0,0|3,0,0]=4 15 B9R1.7 Cc1nc(c[nH]1)CCN Molport-016-899-695 [0,1,0,0,0,0|2,0,0]=3 16 B9R1.7 Cc1nc(c[nH]1)CCO Molport-047-913-693 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.7 Cc1ncc(s1)CCN Molport-014-954-211 [0,1,0,0,0,0|2,0,0]=3 18 B9R1.7 Cc1ncc(s1)CCN Molport-046-071-567 [0,1,0,0,0,0|2,0,0]=3 19 B9R1.7 Cc1ncc(s1)CCO Molport-020-248-493 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.7 Cn1cnc(c1)CCN Molport-003-958-757 [0,1,0,0,0,0|2,0,0]=3 21 B9R1.7 Cn1cnc(c1)CCN Molport-004-946-867 [0,1,0,0,0,0|2,0,0]=3 22 B9R1.7 Cn1cnc(c1)CCN Molport-006-803-985 [0,1,0,0,0,0|2,0,0]=3 23 B9R1.7 Cn1cnc(c1)CCN Molport-051-776-635 [0,1,0,0,0,0|2,0,0]=3 24 B9R1.7 Cn1cnc(c1)CCO Molport-029-503-122 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.11 CC(CN)c1c[nH]cn1 Molport-044-623-395 [0,1,0,0,0,0|2,0,0]=3 26 B9R1.11 CC(CN)c1ncc[nH]1 Molport-046-141-617 [0,1,0,0,0,0|3,0,0]=4 27 B9R1.11 CC(CN)c1nccs1 Molport-003-738-588 [0,1,0,0,0,0|3,0,0]=4 28 B9R1.11 CC(CN)n1ccnc1 Molport-029-997-433 [0,1,0,0,0,0|2,0,0]=3 29 B9R1.11 CC(CO)n1ccnc1 Molport-004-774-972 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.11 CCC(N)c1cscn1 Molport-046-851-564 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.11 CNC(C)c1cscn1 Molport-006-829-027 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.12 CCOCn1ccnc1 Molport-006-715-265 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.12 CNCCc1c[nH]cn1 Molport-003-983-643 [0,1,0,0,0,0|2,0,0]=3 34 B9R1.12 CNCCc1cnc[nH]1 Molport-028-912-982 [0,1,0,0,0,0|2,0,0]=3 35 B9R1.12 CNCCc1cnc[nH]1 Molport-051-864-481 [0,1,0,0,0,0|2,0,0]=3 36 B9R1.12 NCCCc1c[nH]cn1 Molport-044-195-723 [0,1,0,0,0,0|2,0,0]=3 37 B9R1.12 NCCCc1ncc[nH]1 Molport-012-002-715 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.12 NCCCc1ncc[nH]1 Molport-023-334-823 [0,1,0,0,0,0|3,0,0]=4 39 B9R1.12 NCCCn1ccnc1 Molport-001-791-771 [0,1,0,0,0,0|2,0,0]=3 40 B9R1.12 OCCCc1c[nH]cn1 Molport-028-744-932 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.12 OCCCc1cnc[nH]1 Molport-038-934-509 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.12 OCCCc1cncs1 Molport-033-482-203 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.12 OCCCn1ccnc1 Molport-002-500-773 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.12 OCCCn1ccnc1 Molport-029-997-318 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.13 CC(N)Cc1c[nH]cn1 Molport-022-657-306 [0,1,0,0,0,0|2,0,0]=3 46 B9R1.13 CC(N)Cc1c[nH]cn1 Molport-042-620-575 [0,1,0,0,0,0|2,0,0]=3 47 B9R1.13 CC(N)Cn1ccnc1 Molport-001-760-323 [0,1,0,0,0,0|2,0,0]=3 48 B9R1.13 CC(N)Cn1ccnc1 Molport-002-742-959 [0,1,0,0,0,0|2,0,0]=3 49 B9R1.13 C[C@@H](N)Cc1c[nH]cn1 Molport-003-824-922 [0,1,0,0,0,0|2,0,0]=3 50 B9R1.13 C[C@@H](N)Cc1c[nH]cn1 Molport-003-941-593 [0,1,0,0,0,0|2,0,0]=3 51 B9R1.13 C[C@@H](N)Cc1c[nH]cn1 Molport-039-139-885 [0,1,0,0,0,0|2,0,0]=3 52 B9R1.13 C[C@@H](N)Cc1cnc[nH]1 Molport-046-683-702 [0,1,0,0,0,0|2,0,0]=3 53 B9R1.13 C[C@@H](O)Cn1ccnc1 Molport-047-926-339 [0,1,0,0,0,0|3,0,0]=4 54 B9R1.13 C[C@H](N)Cc1c[nH]cn1 Molport-003-983-622 [0,1,0,0,0,0|2,0,0]=3 55 B9R1.13 C[C@H](N)Cc1c[nH]cn1 Molport-035-936-385 [0,1,0,0,0,0|2,0,0]=3 56 B9R1.13 C[C@H](N)Cc1c[nH]cn1 Molport-047-933-189 [0,1,0,0,0,0|2,0,0]=3 57 B9R1.33 Cc1[nH]cnc1CCN Molport-006-803-984 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.33 Cc1[nH]cnc1CCN Molport-020-168-020 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.33 Cc1[nH]cnc1CCN Molport-020-394-337 [0,1,0,0,0,0|2,0,0]=3 60 B9R1.33 Cc1nc[nH]c1CCN Molport-003-983-497 [0,1,0,0,0,0|2,0,0]=3 61 B9R1.33 Cc1nc[nH]c1CCN Molport-047-918-697 [0,1,0,0,0,0|2,0,0]=3 62 B9R1.33 Cc1ncsc1CCO Molport-001-761-367 [0,1,0,0,0,0|3,0,0]=4 63 B9R1.33 Cc1scnc1CCO Molport-029-503-580 [0,1,0,0,0,0|2,0,0]=3 64 B9R1.33 Cn1cncc1CCN Molport-003-848-900 [0,1,0,0,0,0|2,0,0]=3 65 B9R1.33 Cn1cncc1CCN Molport-003-958-832 [0,1,0,0,0,0|2,0,0]=3 66 B9R1.33 Cn1cncc1CCO Molport-020-916-109 [0,1,0,0,0,0|3,0,0]=4 67 B9R2.2 C1CC1c2c[nH]cn2 Molport-035-941-949 [0,0,0,1,0,0|3,0,0]=4 68 B9R2.2 C1CC1c2cnc[nH]2 Molport-039-063-398 [0,0,0,1,0,0|3,0,0]=4 69 B9R2.3 C1Cc2c[nH]nc2C1 Molport-015-161-092 [0,0,0,1,0,0|3,0,0]=4 70 B9R2.3 C1Cc2c[nH]nc2C1 Molport-023-222-385 [0,0,0,1,0,0|3,0,0]=4 71 B9R2.3 C1Cc2cncn2C1 Molport-042-683-709 [0,0,0,1,0,0|3,0,0]=4 72 B9R2.3 C1Cc2nc[nH]c2C1 Molport-008-420-805 [0,0,0,1,0,0|3,0,0]=4 73 B9R2.3 C1Cc2nccn2C1 Molport-009-197-061 [0,0,0,1,0,0|3,0,0]=4 74 B8R1.1 CC[n+]1ccn(c1)C Molport-009-756-304 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.1 CC[n+]1ccn(c1)C Molport-019-905-231 [1,1,0,0,0,0|2,0,0]=4 76 B8R1.1 CC[n+]1ccn(c1)C Molport-028-746-209 [1,1,0,0,0,0|2,0,0]=4 77 B8R1.1 CC[n+]1ccn(c1)C Molport-028-747-166 [1,1,0,0,0,0|2,0,0]=4 78 B8R1.1 CC[n+]1ccn(c1)C Molport-044-562-209 [1,1,0,0,0,0|2,0,0]=4 79 B8R1.1 CC[n+]1ccn(c1)C Molport-046-195-988 [1,1,0,0,0,0|2,0,0]=4 80 B8R1.1 CC[n+]1ccn(c1)C Molport-049-248-103 [1,1,0,0,0,0|2,0,0]=4 81 B8R1.1 CC[n+]1ccn(c1)C Molport-051-929-009 [1,1,0,0,0,0|2,0,0]=4 82 B8R1.1 CCc1cnc([nH]1)C Molport-036-201-867 [1,1,0,0,0,0|2,0,0]=4 83 B8R1.1 CCn1cc[n+](c1)C Molport-003-928-924 [1,1,0,0,0,0|2,0,0]=4 84 B8R1.1 CCn1cc[n+](c1)C Molport-003-935-437 [1,1,0,0,0,0|2,0,0]=4 85 B8R1.1 CCn1cc[n+](c1)C Molport-003-936-950 [1,1,0,0,0,0|2,0,0]=4 86 B8R1.1 CCn1cc[n+](c1)C Molport-003-939-628 [1,1,0,0,0,0|2,0,0]=4 87 B8R1.1 CCn1cc[n+](c1)C Molport-038-941-737 [1,1,0,0,0,0|2,0,0]=4 88 B8R1.1 CCn1cc[n+](c1)C Molport-039-323-694 [1,1,0,0,0,0|2,0,0]=4 89 B8R1.1 CCn1cc[n+](c1)C Molport-044-723-567 [1,1,0,0,0,0|2,0,0]=4 90 B8R1.1 CCn1cc[n+](c1)C Molport-046-156-835 [1,1,0,0,0,0|2,0,0]=4 91 B8R1.1 CCn1cc[n+](c1)C Molport-046-933-358 [1,1,0,0,0,0|2,0,0]=4 92 B8R1.1 CCn1cc[n+](c1)C Molport-047-971-095 [1,1,0,0,0,0|2,0,0]=4 93 B8R1.1 CCn1cc[n+](c1)C Molport-047-971-460 [1,1,0,0,0,0|2,0,0]=4 94 B8R1.1 CCn1cc[n+](c1)C Molport-053-106-120 [1,1,0,0,0,0|2,0,0]=4 95 B8R1.1 CCn1cnc(c1)C Molport-039-049-983 [1,1,0,0,0,0|2,0,0]=4 96 B8R1.7 CC(C)c1c[nH]cn1 Molport-028-747-057 [1,1,0,0,0,0|2,0,0]=4 97 B8R1.7 CC(C)c1cnc[nH]1 Molport-046-684-029 [1,1,0,0,0,0|2,0,0]=4 98 B8R1.7 CC(C)c1cncs1 Molport-027-835-199 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.4 CCCc1nccnc1C Molport-003-929-062 [0,1,0,0,0,1|2,0,0]=4 100 B10R1.18 CC(C)Cc1cnccn1 Molport-005-935-762 [0,1,0,0,0,1|2,0,0]=4 101 B10R1.14 CCC(C)c1csc(n1)C Molport-035-368-020 [0,2,0,0,0,0|2,0,0]=4 102 B10R1.14 CCC(C)c1csc(n1)N Molport-046-419-740 [0,2,0,0,0,0|2,0,0]=4 103 B10R1.14 Cc1nc(cs1)C(N)CN Molport-028-949-110 [0,2,0,0,0,0|1,0,0]=3 104 B10R1.14 Cn1cnc(c1)C(O)CN Molport-022-148-102 [0,2,0,0,0,0|2,0,0]=4 105 B10R1.16 C[n+]1ccn(c1)CCCN Molport-051-644-893 [0,2,0,0,0,0|2,0,0]=4 106 B10R1.16 Cc1cn(cn1)CCCN Molport-046-203-951 [0,2,0,0,0,0|2,0,0]=4 107 B10R1.16 Cc1nc(cs1)CCCN Molport-020-916-062 [0,2,0,0,0,0|1,0,0]=3 108 B10R1.16 Cn1cc[n+](c1)CCCN Molport-046-935-838 [0,2,0,0,0,0|2,0,0]=4 109 B10R1.16 Cn1cc[n+](c1)CCCN Molport-049-216-606 [0,2,0,0,0,0|2,0,0]=4 110 B10R1.16 Cn1cnc(c1)CCCN Molport-047-481-124 [0,2,0,0,0,0|2,0,0]=4 111 B10R1.16 NCCCc1csc(n1)N Molport-006-703-070 [0,2,0,0,0,0|1,0,0]=3 112 B10R1.16 NCCCc1csc(n1)N Molport-016-583-060 [0,2,0,0,0,0|1,0,0]=3 113 B10R1.54 CC(N)Cc1cn(cn1)C Molport-029-722-978 [0,2,0,0,0,0|2,0,0]=4 114 B10R1.54 CC(O)Cc1csc(n1)C Molport-014-800-660 [0,2,0,0,0,0|2,0,0]=4 115 B10R1.54 C[C@@H](N)Cc1cn(cn1)C Molport-004-776-038 [0,2,0,0,0,0|2,0,0]=4 116 B10R1.54 C[C@H](N)Cc1cn(cn1)C Molport-051-913-000 [0,2,0,0,0,0|2,0,0]=4 117 B10R1.94 Cc1ncn(c1C)CCN Molport-013-608-393 [0,2,0,0,0,0|2,0,0]=4 118 B10R1.94 Cc1ncn(c1C)CCN Molport-029-997-999 [0,2,0,0,0,0|2,0,0]=4 119 B10R1.96 CCc1nc(c[nH]1)CCN Molport-044-556-898 [0,2,0,0,0,0|2,0,0]=4 120 B10R1.96 CCc1ncc([nH]1)CCN Molport-028-913-002 [0,2,0,0,0,0|2,0,0]=4 121 B10R1.96 NCCn1cnc(c1)CO Molport-051-780-213 [0,2,0,0,0,0|2,0,0]=4 122 B10R1.130 Cc1nc(sc1CCN)N Molport-003-983-513 [0,2,0,0,0,0|2,0,0]=4 123 B10R1.130 Cc1nc(sc1CCN)N Molport-044-831-861 [0,2,0,0,0,0|2,0,0]=4 124 B10R1.131 Cc1nc(cn1C)CCN Molport-023-282-472 [0,2,0,0,0,0|2,0,0]=4 125 B10R1.6 CC(C)(CN)c1cnc[nH]1 Molport-047-547-388 [0,2,0,0,0,0|2,0,0]=4 126 B10R1.6 CC(C)(CN)n1ccnc1 Molport-042-623-645 [0,2,0,0,0,0|2,0,0]=4 127 B10R1.11 CC(CCN)n1ccnc1 Molport-008-154-406 [0,2,0,0,0,0|2,0,0]=4 128 B10R1.23 CC(N)C(C)n1ccnc1 Molport-003-762-597 [0,2,0,0,0,0|2,0,0]=4 129 B10R1.21 CNCCCn1ccnc1 Molport-005-938-818 [0,2,0,0,0,0|2,0,0]=4 130 B10R1.21 NCCCCc1c[nH]cn1 Molport-047-641-847 [0,2,0,0,0,0|2,0,0]=4 131 B10R1.21 NCCCCn1ccnc1 Molport-002-011-676 [0,2,0,0,0,0|2,0,0]=4 132 B10R1.21 NCCCCn1ccnc1 Molport-006-704-319 [0,2,0,0,0,0|2,0,0]=4 133 B10R1.27 CC(CN)Cn1ccnc1 Molport-016-633-863 [0,2,0,0,0,0|2,0,0]=4 134 B10R1.27 CCC(N)Cn1ccnc1 Molport-002-731-239 [0,2,0,0,0,0|2,0,0]=4 135 B10R1.27 CCC(N)Cn1ccnc1 Molport-008-382-958 [0,2,0,0,0,0|2,0,0]=4 136 B10R1.27 CNC(C)Cc1cncs1 Molport-031-695-947 [0,2,0,0,0,0|2,0,0]=4 137 B10R1.27 NC(CO)Cc1cncs1 Molport-044-203-117 [0,2,0,0,0,0|2,0,0]=4 138 B10R1.27 N[C@@H](CO)Cc1cnc[nH]1 Molport-052-061-986 [0,2,0,0,0,0|2,0,0]=4 139 B10R1.27 N[C@@H](CO)Cc1cscn1 Molport-051-808-993 [0,2,0,0,0,0|1,0,0]=3 140 B10R1.27 N[C@H](CO)Cc1cnc[nH]1 Molport-039-333-877 [0,2,0,0,0,0|2,0,0]=4 141 B10R1.27 N[C@H](CO)Cc1cnc[nH]1 Molport-046-692-984 [0,2,0,0,0,0|2,0,0]=4 142 B10R1.29 Cc1cncn1CCCN Molport-022-468-753 [0,2,0,0,0,0|2,0,0]=4 143 B10R1.29 Cc1cncn1CCCN Molport-023-313-486 [0,2,0,0,0,0|2,0,0]=4 144 B10R1.29 Cc1ncsc1CCCN Molport-013-781-578 [0,2,0,0,0,0|2,0,0]=4 145 B10R1.29 Cc1ncsc1CCCN Molport-016-582-977 [0,2,0,0,0,0|2,0,0]=4 146 B10R1.29 Cn1cncc1CCCN Molport-051-688-971 [0,2,0,0,0,0|2,0,0]=4 147 B10R1.66 CN(C)CCc1cc[nH]c1 Molport-036-378-205 [0,2,0,0,0,0|1,0,0]=3 148 B10R1.64 CC(N)Cc1cncn1C Molport-020-356-540 [0,2,0,0,0,0|2,0,0]=4 149 B10R1.281 CC(C)(N)Cn1ccnc1 Molport-022-468-788 [0,2,0,0,0,0|2,0,0]=4 150 B10R1.187 Cc1cnc(n1CCN)C Molport-047-133-312 [0,2,0,0,0,0|2,0,0]=4 151 B10R2.2 NC1Cc2cn[nH]c2C1 Molport-022-470-056 [0,1,0,1,0,0|2,0,0]=4 152 B10R2.2 NC1Cc2cncn2C1 Molport-039-240-142 [0,1,0,1,0,0|2,0,0]=4 153 B10R2.2 NC1Cc2nccn2C1 Molport-022-470-057 [0,1,0,1,0,0|2,0,0]=4 154 B10R2.14 Nc1nc(cs1)C2CC2 Molport-002-705-003 [0,1,0,1,0,0|2,0,0]=4 155 B10R2.14 Nc1nc(cs1)C2CC2 Molport-004-802-368 [0,1,0,1,0,0|2,0,0]=4 156 B10R2.32 NC1CCc2c1cn[nH]2 Molport-051-783-876 [0,1,0,1,0,0|2,0,0]=4 157 B10R2.32 NC1CCn2c1cnc2 Molport-004-774-699 [0,1,0,1,0,0|2,0,0]=4 158 B10R2.32 NC1CCn2c1cnc2 Molport-039-240-174 [0,1,0,1,0,0|2,0,0]=4 159 B10R2.32 NC1CCn2c1ncc2 Molport-004-774-712 [0,1,0,1,0,0|2,0,0]=4 160 B10R2.32 NC1CCn2c1ncc2 Molport-051-815-784 [0,1,0,1,0,0|2,0,0]=4 161 B10R2.32 Nc1snc2c1CCC2 Molport-004-969-006 [0,1,0,1,0,0|2,0,0]=4 162 B10R2.32 Nc1snc2c1CCC2 Molport-019-922-530 [0,1,0,1,0,0|2,0,0]=4 163 B10R2.32 Nc1snc2c1CCC2 Molport-029-997-534 [0,1,0,1,0,0|2,0,0]=4 164 B10R2.5 N[C@@H]1C[C@H]1c2c[nH]cn2 Molport-044-436-011 [0,1,0,1,0,0|2,0,0]=4 165 B10R2.5 N[C@@H]1C[C@H]1c2cncs2 Molport-051-776-810 [0,1,0,1,0,0|2,0,0]=4 166 B10R2.5 N[C@@H]1C[C@H]1c2cscn2 Molport-051-774-638 [0,1,0,1,0,0|1,0,0]=3 167 B10R2.16 NC1(CC1)c2cscn2 Molport-022-147-974 [0,1,0,1,0,0|2,0,0]=4 168 B10R2.136 C1NCC1c2cnc[nH]2 Molport-046-687-760 [0,1,0,1,0,0|2,0,0]=4 169 B10R2.136 C1NCC1c2cnc[nH]2 Molport-046-699-182 [0,1,0,1,0,0|2,0,0]=4 170 B10R2.136 C1NCC1n2ccnc2 Molport-020-074-407 [0,1,0,1,0,0|2,0,0]=4 171 B10R2.136 C1NCC1n2ccnc2 Molport-023-332-198 [0,1,0,1,0,0|2,0,0]=4 172 B10R2.136 C1NCC1n2ccnc2 Molport-052-013-440 [0,1,0,1,0,0|2,0,0]=4