0 B11R1.17 CCCCc1nccnc1C Molport-006-121-681 [0,1,0,0,0,0|2,0,0]=3 1 B11R1.17 CCCOc1nccnc1C Molport-052-044-424 [0,1,0,0,0,0|3,0,0]=4 2 B11R1.24 CCCOc1cncc(n1)C Molport-003-891-633 [0,1,0,0,0,0|3,0,0]=4 3 B11R1.28 CCCCCc1cnccn1 Molport-003-849-829 [0,1,0,0,0,0|2,0,0]=3 4 B11R1.28 OCCCCc1cnccn1 Molport-039-139-404 [0,1,0,0,0,0|2,0,0]=3 5 B11R1.40 CNC(C)Cc1cnccn1 Molport-004-853-294 [0,1,0,0,0,0|1,0,0]=2 6 B11R1.91 CC(C)CCc1cnccn1 Molport-044-586-669 [0,1,0,0,0,0|2,0,0]=3 7 B11R1.91 CN(C)CCc1cnccn1 Molport-003-913-390 [0,1,0,0,0,0|1,0,0]=2 8 B11R1.91 CN(C)CCc1cnccn1 Molport-042-666-213 [0,1,0,0,0,0|1,0,0]=2 9 B11R2.1 CC1CCc2c1nccn2 Molport-003-960-089 [0,0,0,1,0,0|2,0,0]=3 10 B11R2.20 C1CCc2nccnc2C1 Molport-003-698-672 [0,0,0,1,0,0|2,0,0]=3 11 B11R2.20 C1CCc2ncncc2C1 Molport-006-725-754 [0,0,0,1,0,0|2,0,0]=3 12 B9R1.12 CCCCc1ncc[nH]1 Molport-005-941-725 [0,0,0,0,1,0|2,0,0]=3 13 B9R1.12 CNCCc1c[nH]cn1 Molport-003-983-643 [0,0,0,0,1,0|1,0,0]=2 14 B9R1.12 CNCCc1cnc[nH]1 Molport-028-912-982 [0,0,0,0,1,0|1,0,1]=3 15 B9R1.12 CNCCc1cnc[nH]1 Molport-051-864-481 [0,0,0,0,1,0|1,0,1]=3 16 B9R1.12 NCCCc1c[nH]cn1 Molport-044-195-723 [0,0,0,0,1,0|3,0,0]=4 17 B9R1.12 NCCCc1ncc[nH]1 Molport-012-002-715 [0,0,0,0,1,0|3,0,0]=4 18 B9R1.12 NCCCc1ncc[nH]1 Molport-023-334-823 [0,0,0,0,1,0|3,0,0]=4 19 B9R1.12 OCCCc1c[nH]cn1 Molport-028-744-932 [0,0,0,0,1,0|3,0,0]=4 20 B9R1.12 OCCCc1ncc[nH]1 Molport-046-699-577 [0,0,0,0,1,0|3,0,0]=4 21 B10R1.4 CCCc1nccnc1C Molport-003-929-062 [1,1,0,0,0,0|1,0,0]=3 22 B10R1.18 CC(C)Cc1cnccn1 Molport-005-935-762 [1,1,0,0,0,0|1,0,0]=3 23 B10R1.11 CCCC(O)c1nccs1 Molport-006-831-247 [0,1,0,0,1,0|2,0,0]=4 24 B10R1.11 CNCC(C)c1nccs1 Molport-008-643-964 [0,1,0,0,1,0|1,0,0]=3 25 B10R1.11 COCC(O)c1nccs1 Molport-006-831-257 [0,1,0,0,1,0|2,0,0]=4 26 B10R1.16 CNCCc1ncc(s1)C Molport-013-352-322 [0,1,0,0,1,0|1,0,0]=3 27 B10R1.16 CNCCc1ncc(s1)C Molport-051-782-957 [0,1,0,0,1,0|1,0,0]=3 28 B10R1.21 CNCCCn1ccnc1 Molport-005-938-818 [0,1,0,0,1,0|2,0,0]=4 29 B10R1.21 NCCCCc1c[nH]cn1 Molport-047-641-847 [0,1,0,0,1,0|2,0,0]=4 30 B10R1.21 NCCCCc1ncc[nH]1 Molport-039-060-520 [0,1,0,0,1,0|2,0,0]=4 31 B10R1.21 OCCCCc1nccs1 Molport-025-891-814 [0,1,0,0,1,0|2,0,0]=4 32 B10R1.27 CNC(C)Cc1cncs1 Molport-031-695-947 [0,1,0,0,1,0|2,0,0]=4 33 B10R1.66 CN(C)CCc1cc[nH]c1 Molport-036-378-205 [0,1,0,0,1,0|1,0,0]=3 34 B12R1.28 CCCCNc1cncc(n1)Cl Molport-001-758-783 [0,2,0,0,0,0|2,0,0]=4 35 B12R1.226 CC(C)CCc1cncc(n1)C Molport-028-747-082 [0,2,0,0,0,0|2,0,0]=4 36 B10R2.136 C1CC(C1)c2c[nH]cn2 Molport-039-134-642 [0,0,0,1,1,0|2,0,0]=4 37 B10R2.136 C1CC(C1)c2ncc[nH]2 Molport-035-770-645 [0,0,0,1,1,0|2,0,0]=4 38 B10R2.136 C1NCC1c2cnc[nH]2 Molport-046-687-760 [0,0,0,1,1,0|1,0,1]=4 39 B10R2.136 C1NCC1c2cnc[nH]2 Molport-046-699-182 [0,0,0,1,1,0|1,0,1]=4 40 B10R2.136 C1NCC1c2ncc[nH]2 Molport-046-201-427 [0,0,0,1,1,0|1,0,0]=3 41 B10R2.136 C1NCC1c2nccs2 Molport-029-997-844 [0,0,0,1,1,0|1,0,0]=3 42 B10R2.136 C1NCC1c2nccs2 Molport-039-028-319 [0,0,0,1,1,0|1,0,0]=3 43 B10R2.136 C1NCC1n2ccnc2 Molport-020-074-407 [0,0,0,1,1,0|2,0,0]=4 44 B10R2.136 C1NCC1n2ccnc2 Molport-023-332-198 [0,0,0,1,1,0|2,0,0]=4 45 B10R2.136 C1NCC1n2ccnc2 Molport-052-013-440 [0,0,0,1,1,0|2,0,0]=4 46 B12R2.24 Brc1cnc2c(n1)CCCC2 Molport-029-215-988 [0,1,0,1,0,0|2,0,0]=4 47 B12R2.24 CC1CCc2cccnc2C1 Molport-044-558-580 [0,1,0,1,0,0|1,0,0]=3 48 B12R2.24 CC1CCc2ncccc2C1 Molport-044-558-474 [0,1,0,1,0,0|1,0,0]=3 49 B12R2.24 CN1CCc2ncncc2C1 Molport-004-758-697 [0,1,0,1,0,0|1,0,0]=3 50 B12R2.24 CN1CCc2ncncc2C1 Molport-028-960-522 [0,1,0,1,0,0|1,0,0]=3 51 B12R2.24 Cc1ccc2c(n1)CCCC2 Molport-003-984-643 [0,1,0,1,0,0|1,0,0]=3 52 B12R2.24 Cc1cnc2c(c1)CCCC2 Molport-003-894-630 [0,1,0,1,0,0|1,0,0]=3 53 B12R2.24 Cc1ncc2c(n1)CCNC2 Molport-002-052-542 [0,1,0,1,0,0|1,0,0]=3 54 B12R2.24 Cc1ncc2c(n1)CCNC2 Molport-008-475-770 [0,1,0,1,0,0|1,0,0]=3 55 B12R2.24 Clc1cc2c(nn1)CCCC2 Molport-013-776-033 [0,1,0,1,0,0|2,0,0]=4 56 B12R2.24 Clc1cnc2c(n1)CCCC2 Molport-028-754-598 [0,1,0,1,0,0|2,0,0]=4 57 B12R2.24 Clc1ncc2c(n1)CCCC2 Molport-029-496-002 [0,1,0,1,0,0|2,0,0]=4 58 B12R2.24 N=c1nc2c(c[nH]1)CCCC2 Molport-046-682-051 [0,1,0,1,0,0|2,0,0]=4 59 B12R2.24 NC1CCc2ncncc2C1 Molport-022-467-332 [0,1,0,1,0,0|2,0,0]=4 60 B12R2.24 Nc1ncc2c(n1)CCCC2 Molport-003-179-046 [0,1,0,1,0,0|2,0,0]=4 61 B12R2.24 O=c1cc2c(n[nH]1)CCCC2 Molport-000-489-686 [0,1,0,1,0,0|2,0,0]=4 62 B12R2.24 O=c1cc2c(n[nH]1)CCCC2 Molport-002-105-151 [0,1,0,1,0,0|2,0,0]=4 63 B12R2.24 O=c1cnc2c([nH]1)CCCC2 Molport-003-811-865 [0,1,0,1,0,0|2,0,0]=4 64 B12R2.24 Oc1cc2c(nn1)CCCC2 Molport-019-938-498 [0,1,0,1,0,0|2,0,0]=4 65 B12R2.24 Oc1cnc2c(n1)CCCC2 Molport-035-678-993 [0,1,0,1,0,0|2,0,0]=4 66 B12R2.2 C1CC(CN1)c2cnccn2 Molport-019-954-506 [0,1,0,1,0,0|1,0,0]=3 67 B12R2.2 C1CC(CN1)c2cnccn2 Molport-042-668-493 [0,1,0,1,0,0|1,0,0]=3 68 B12R2.2 C1CC(CN1)c2ncccn2 Molport-044-626-102 [0,1,0,1,0,0|1,0,0]=3 69 B12R2.2 C1CNC(C1)c2ccncn2 Molport-028-956-485 [0,1,0,1,0,0|2,0,0]=4 70 B12R2.2 C1CNC(C1)c2cnccn2 Molport-019-954-502 [0,1,0,1,0,0|2,0,0]=4 71 B12R2.2 C1CNC(C1)c2cnccn2 Molport-020-393-036 [0,1,0,1,0,0|2,0,0]=4 72 B12R2.2 C1CNC(C1)c2cnccn2 Molport-028-956-715 [0,1,0,1,0,0|2,0,0]=4 73 B12R2.2 C1CNC(C1)c2ncccn2 Molport-011-129-252 [0,1,0,1,0,0|2,0,0]=4 74 B12R2.2 C1CNC(C1)c2ncccn2 Molport-042-683-568 [0,1,0,1,0,0|2,0,0]=4 75 B12R2.2 C1CN[C@@H](C1)c2cnccn2 Molport-047-934-245 [0,1,0,1,0,0|2,0,0]=4 76 B12R2.2 C1CN[C@H](C1)c2cnccn2 Molport-047-934-244 [0,1,0,1,0,0|2,0,0]=4 77 B12R2.116 NC1(CCC1)c2cnccn2 Molport-047-113-001 [0,1,0,1,0,0|2,0,0]=4 78 B12R2.1081 CC1CCCc2c1cccn2 Molport-044-558-473 [0,1,0,1,0,0|1,0,0]=3 79 B12R2.1081 CC1CNCc2c1ncnc2 Molport-044-422-365 [0,1,0,1,0,0|1,0,0]=3 80 B12R2.1081 Cc1ccnc2c1CCCC2 Molport-038-942-430 [0,1,0,1,0,0|1,0,0]=3 81 B12R2.1081 Cc1ccnc2c1CCCC2 Molport-051-763-305 [0,1,0,1,0,0|1,0,0]=3 82 B12R2.1081 Cc1ncnc2c1CNCC2 Molport-046-677-675 [0,1,0,1,0,0|1,0,0]=3 83 B12R2.1081 Clc1ncnc2c1CCCC2 Molport-013-678-772 [0,1,0,1,0,0|2,0,0]=4 84 B12R2.1081 NC1CCCc2c1nccn2 Molport-004-754-999 [0,1,0,1,0,0|2,0,0]=4 85 B12R2.1081 Nc1ncnc2c1CCCC2 Molport-004-755-041 [0,1,0,1,0,0|2,0,0]=4 86 B12R2.1081 O=c1[nH]cnc2c1CCCC2 Molport-013-679-022 [0,1,0,1,0,0|2,0,0]=4 87 B12R2.1081 OC1CCCc2c1nccn2 Molport-044-195-273 [0,1,0,1,0,0|2,0,0]=4 88 B12R2.1081 Oc1ncnc2c1CCCC2 Molport-003-894-437 [0,1,0,1,0,0|2,0,0]=4 89 B12R2.203 C[C@@H]1CCc2c1c(ncn2)Cl Molport-049-219-636 [0,1,0,1,0,0|2,0,0]=4 90 B12R2.2057 C(Nc1cnccn1)C2CC2 Molport-005-168-667 [0,1,0,1,0,0|2,0,0]=4 91 B8R1.8 CCCc1ncc[nH]1 Molport-005-933-441 [1,0,0,0,1,0|1,0,0]=3