0 B14R2.21 Brc1cccc(c1)C2CCCCC2 Molport-021-800-589 [0,0,0,0,0,0|2,1,0]=3 1 B14R2.21 Cc1cccc(c1)C2CCCCC2 Molport-021-876-327 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.21 Cc1ccnc(c1)C2CCCCC2 Molport-030-005-578 [0,0,0,0,0,0|4,0,0]=4 3 B14R2.21 Cc1cncc(n1)C2CCNCC2 Molport-020-264-322 [0,0,0,0,0,0|4,0,0]=4 4 B14R2.21 Clc1cc(ncn1)C2CCCCC2 Molport-002-052-758 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.21 Ic1cccc(c1)C2CCCCC2 Molport-047-740-734 [0,0,0,0,0,0|2,1,0]=3 6 B14R2.21 Nc1cccc(c1)C2CCCCC2 Molport-008-513-178 [0,0,0,0,0,0|3,0,0]=3 7 B14R2.21 O=c1cccc([nH]1)C2CCCCC2 Molport-047-411-439 [0,0,0,0,0,0|4,0,0]=4 8 B14R2.21 Oc1cccc(c1)C2CCCCC2 Molport-009-684-761 [0,0,0,0,0,0|3,0,0]=3 9 B13R2.3 C1CC(CCN1)c2cnccn2 Molport-020-745-794 [1,0,0,0,0,0|3,0,0]=4 10 B13R2.3 C1CC(CCN1)c2cnccn2 Molport-028-951-653 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.3 C1CCC(CC1)c2ccccc2 Molport-001-780-039 [1,0,0,0,0,0|2,0,0]=3 12 B13R2.3 C1CCC(CC1)c2ccncc2 Molport-000-165-731 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.3 C1CCC(CC1)c2ccncc2 Molport-038-949-300 [1,0,0,0,0,0|3,0,0]=4 14 B15R2.17 CCc1cccc(c1)C2CCCCC2 Molport-044-723-407 [0,1,0,0,0,0|3,0,0]=4 15 B15R2.17 CNc1cccc(c1)C2CCCCC2 Molport-047-557-850 [0,1,0,0,0,0|3,0,0]=4 16 B15R2.17 COc1cncc(n1)N2CCNCC2 Molport-047-651-773 [0,1,0,0,0,0|3,0,0]=4 17 B15R2.28 CC1CCC(CC1)c2cccc(c2)C Molport-039-012-745 [0,1,0,0,0,0|3,0,0]=4 18 B15R2.28 CN1CCC(CC1)c2cccc(c2)Br Molport-021-902-425 [0,1,0,0,0,0|1,1,0]=3 19 B15R2.28 CN1CCC(CC1)c2cccc(c2)N Molport-008-513-273 [0,1,0,0,0,0|2,0,0]=3 20 B15R2.28 CN1CCC(CC1)c2cccc(c2)N Molport-046-430-807 [0,1,0,0,0,0|2,0,0]=3 21 B15R2.28 CN1CCC(CC1)c2ccnc(c2)Cl Molport-020-264-441 [0,1,0,0,0,0|2,0,0]=3 22 B15R2.28 CN1CCC(CC1)c2cncc(n2)Cl Molport-020-264-133 [0,1,0,0,0,0|3,0,0]=4 23 B15R2.28 CN1CCN(CC1)c2cc(=O)[nH]cn2 Molport-034-782-308 [0,1,0,0,0,0|3,0,0]=4 24 B15R2.28 CN1CCN(CC1)c2cc(ncn2)N Molport-009-197-480 [0,1,0,0,0,0|3,0,0]=4 25 B15R2.28 CN1CCN(CC1)c2cc[nH]c(=N)n2 Molport-053-107-077 [0,1,0,0,0,0|3,0,0]=4 26 B15R2.28 CN1CCN(CC1)c2cccc(n2)N Molport-021-799-812 [0,1,0,0,0,0|2,0,0]=3 27 B15R2.28 CN1CCN(CC1)c2ccnc(c2)N Molport-021-799-811 [0,1,0,0,0,0|2,0,0]=3 28 B15R2.28 CN1CCN(CC1)c2nccc(=O)[nH]2 Molport-009-014-595 [0,1,0,0,0,0|3,0,0]=4 29 B15R2.28 CN1CCN(CC1)c2nccc(n2)N Molport-009-197-437 [0,1,0,0,0,0|3,0,0]=4 30 B15R2.28 O[C@H]1CC[C@H](CC1)c2cccc(c2)F Molport-046-932-528 [0,1,0,0,0,0|2,1,0]=4 31 B15R2.30 CC1CCCC(C1)c2cccc(c2)C Molport-035-789-779 [0,1,0,0,0,0|3,0,0]=4 32 B15R2.30 NC1CCCC(C1)c2cccc(c2)Cl Molport-039-241-138 [0,1,0,0,0,0|2,0,0]=3 33 B15R2.30 N[C@@H]1CCC[C@@H](C1)c2cccc(c2)Br Molport-051-729-885 [0,1,0,0,0,0|2,1,0]=4 34 B15R2.30 N[C@@H]1CCC[C@@H](C1)c2cccc(c2)Cl Molport-051-729-883 [0,1,0,0,0,0|2,0,0]=3 35 B15R2.30 N[C@@H]1CCC[C@@H](C1)c2cccc(c2)F Molport-051-729-881 [0,1,0,0,0,0|2,1,0]=4 36 B15R2.32 Cn1ccnc(c1=O)N2CCNCC2 Molport-047-944-276 [0,1,0,0,0,0|3,0,0]=4 37 B15R2.33 Cc1ccc(c(c1)C2CCCCC2)N Molport-021-876-331 [0,1,0,0,0,0|3,0,0]=4 38 B15R2.33 Cc1cnc(c(n1)N2CCNCC2)C Molport-004-288-577 [0,1,0,0,0,0|3,0,0]=4 39 B15R2.33 Cc1cnc(cc1C2CCCCC2)Cl Molport-049-215-784 [0,1,0,0,0,0|3,0,0]=4 40 B15R2.33 Nc1ccc(cc1C2CCCCC2)F Molport-021-876-559 [0,1,0,0,0,0|2,1,0]=4 41 B15R2.33 Nc1ncc(nc1N2CCNCC2)Br Molport-002-506-633 [0,1,0,0,0,0|2,1,0]=4 42 B15R2.33 Nc1ncc(nc1N2CCNCC2)Br Molport-035-690-346 [0,1,0,0,0,0|2,1,0]=4 43 B15R2.94 Cc1cc(ccc1N)C2CCCCC2 Molport-008-513-179 [0,1,0,0,0,0|3,0,0]=4 44 B15R2.94 Cc1cc(ccc1O)C2CCCCC2 Molport-003-009-886 [0,1,0,0,0,0|3,0,0]=4 45 B15R2.94 Cc1ccc(cc1N)C2CCCCC2 Molport-022-250-675 [0,1,0,0,0,0|3,0,0]=4 46 B15R2.94 Nc1cc(ccc1O)C2CCCCC2 Molport-000-001-007 [0,1,0,0,0,0|3,0,0]=4 47 B15R2.94 Nc1ccc(cc1Cl)C2CCCCC2 Molport-051-771-595 [0,1,0,0,0,0|2,0,0]=3 48 B15R2.94 Nc1ccc(cc1F)C2CCCCC2 Molport-021-876-335 [0,1,0,0,0,0|2,1,0]=4 49 B15R2.94 Oc1ccc(cc1Br)C2CCCCC2 Molport-051-822-480 [0,1,0,0,0,0|2,1,0]=4 50 B15R2.332 CC1CCCCC1c2cccc(c2)C Molport-039-012-740 [0,1,0,0,0,0|3,0,0]=4 51 B15R2.332 Cc1cccc(c1)C2CCCCC2N Molport-013-899-539 [0,1,0,0,0,0|3,0,0]=4 52 B15R2.332 Cc1cccc(c1)[C@@H]2CCCC[C@H]2O Molport-035-766-082 [0,1,0,0,0,0|3,0,0]=4 53 B15R2.332 NC1CCCCC1c2cccc(c2)F Molport-013-899-541 [0,1,0,0,0,0|2,1,0]=4 54 B15R2.41951 Cc1cccc(c1)C2(CCCCC2)O Molport-003-909-437 [0,1,0,0,0,0|3,0,0]=4 55 B15R2.41951 NC1(CCCCC1)c2cccc(c2)F Molport-046-530-772 [0,1,0,0,0,0|2,1,0]=4 56 B15R2.41951 OC1(CCCCC1)c2cccc(c2)Br Molport-038-053-313 [0,1,0,0,0,0|2,1,0]=4 57 B15R2.41951 OC1(CCCCC1)c2cccc(c2)Cl Molport-011-693-870 [0,1,0,0,0,0|2,0,0]=3 58 B15R2.41951 OC1(CCCCC1)c2cccc(c2)F Molport-002-893-735 [0,1,0,0,0,0|2,1,0]=4 59 B13R1.6 CCCCCNc1cncc(n1)Cl Molport-001-758-803 [0,0,1,0,0,0|3,0,0]=4 60 B15R3.15276 Nc1cccc2c1C3CCC2CC3 Molport-051-774-321 [0,0,0,1,0,0|3,0,0]=4 61 B13R2.13 Cc1cccc(n1)C2CCNC2 Molport-039-240-219 [0,0,0,0,1,0|3,0,0]=4 62 B13R2.13 Cc1ccnc(c1)C2CCNC2 Molport-039-240-595 [0,0,0,0,1,0|3,0,0]=4 63 B13R2.13 Cc1cncc(c1)C2CCNC2 Molport-039-240-646 [0,0,0,0,1,0|3,0,0]=4 64 B13R2.13 Clc1ccnc(n1)C2CCCC2 Molport-014-468-875 [0,0,0,0,1,0|3,0,0]=4 65 B13R2.13 Nc1cc(ncn1)N2CCCC2 Molport-021-799-972 [0,0,0,0,1,0|3,0,0]=4 66 B13R2.13 Nc1ccnc(n1)N2CCCC2 Molport-006-126-793 [0,0,0,0,1,0|3,0,0]=4 67 B15R2.31 Brc1cccc(c1)CC2CCCCC2 Molport-038-052-490 [0,0,0,0,0,1|2,1,0]=4 68 B15R2.31 Brc1cccc(c1)NC2CCCCC2 Molport-004-389-495 [0,0,0,0,0,1|2,1,0]=4 69 B15R2.31 Brc1cccc(c1)OC2CCCCC2 Molport-005-215-924 [0,0,0,0,0,1|2,1,0]=4 70 B15R2.31 Clc1cc(ccn1)OC2CCCCC2 Molport-020-552-622 [0,0,0,0,0,1|3,0,0]=4 71 B15R2.31 Clc1cccc(c1)NC2CCCCC2 Molport-005-183-414 [0,0,0,0,0,1|2,0,0]=3 72 B15R2.31 Clc1cncc(n1)OC2CCNCC2 Molport-016-576-881 [0,0,0,0,0,1|3,0,0]=4 73 B15R2.31 Clc1cncc(n1)OC2CCNCC2 Molport-028-951-191 [0,0,0,0,0,1|3,0,0]=4 74 B15R2.31 Nc1cccc(c1)OC2CCCCC2 Molport-006-011-351 [0,0,0,0,0,1|3,0,0]=4 75 B15R2.31 Nc1cccc(c1)OC2CCCCC2 Molport-046-790-775 [0,0,0,0,0,1|3,0,0]=4 76 B12R1.28 CCCCNc1cncc(n1)Cl Molport-001-758-783 [1,0,1,0,0,0|2,0,0]=4 77 B14R2.24 Brc1ccccc1C2CCCCC2 Molport-001-791-626 [1,1,0,0,0,0|2,0,0]=4 78 B14R2.24 CC1CNCCN1c2cnccn2 Molport-044-851-177 [1,1,0,0,0,0|2,0,0]=4 79 B14R2.24 Cc1ccccc1C2CCCCC2 Molport-005-939-726 [1,1,0,0,0,0|2,0,0]=4 80 B14R2.24 Cc1nccnc1N2CCNCC2 Molport-004-799-529 [1,1,0,0,0,0|2,0,0]=4 81 B14R2.24 Cc1nccnc1N2CCNCC2 Molport-051-780-546 [1,1,0,0,0,0|2,0,0]=4 82 B14R2.24 Clc1nccnc1N2CCNCC2 Molport-009-198-208 [1,1,0,0,0,0|2,0,0]=4 83 B14R2.24 Clc1nccnc1N2CCNCC2 Molport-042-624-338 [1,1,0,0,0,0|2,0,0]=4 84 B14R2.24 Clc1nccnc1N2CCNCC2 Molport-047-139-433 [1,1,0,0,0,0|2,0,0]=4 85 B14R2.24 NC1CCCCC1c2ccccc2 Molport-046-511-070 [1,1,0,0,0,0|2,0,0]=4 86 B14R2.24 N[C@@H]1CCCC[C@H]1c2ccccc2 Molport-027-807-729 [1,1,0,0,0,0|2,0,0]=4 87 B14R2.24 N[C@@H]1CCCC[C@H]1c2ccccc2 Molport-051-770-471 [1,1,0,0,0,0|2,0,0]=4 88 B14R2.24 Nc1ccccc1C2CCCCC2 Molport-008-513-177 [1,1,0,0,0,0|2,0,0]=4 89 B14R2.24 O=c1[nH]ccnc1N2CCNCC2 Molport-053-110-471 [1,1,0,0,0,0|2,0,0]=4 90 B14R2.24 Oc1nccnc1N2CCNCC2 Molport-029-998-007 [1,1,0,0,0,0|2,0,0]=4 91 B14R2.68 Brc1ccc(cc1)C2CCCCC2 Molport-003-908-167 [1,1,0,0,0,0|2,0,0]=4 92 B14R2.68 CC1CCC(CC1)c2ccccc2 Molport-046-141-350 [1,1,0,0,0,0|2,0,0]=4 93 B14R2.68 CN1CCC(CC1)c2ccccc2 Molport-002-475-075 [1,1,0,0,0,0|1,0,0]=3 94 B14R2.68 CN1CCC(CC1)c2ccccc2 Molport-003-812-840 [1,1,0,0,0,0|1,0,0]=3 95 B14R2.68 Cc1ccc(cc1)C2CCCCC2 Molport-005-939-725 [1,1,0,0,0,0|2,0,0]=4 96 B14R2.68 Clc1ccc(cc1)C2CCCCC2 Molport-021-876-340 [1,1,0,0,0,0|2,0,0]=4 97 B14R2.68 Fc1ccc(cc1)C2CCCCC2 Molport-021-876-328 [1,1,0,0,0,0|2,0,0]=4 98 B14R2.68 Ic1ccc(cc1)C2CCCCC2 Molport-027-355-975 [1,1,0,0,0,0|2,0,0]=4 99 B14R2.68 NC1CCC(CC1)c2ccccc2 Molport-001-982-584 [1,1,0,0,0,0|2,0,0]=4 100 B14R2.68 NC1CCC(CC1)c2ccccc2 Molport-047-932-737 [1,1,0,0,0,0|2,0,0]=4 101 B14R2.68 N[C@H]1CC[C@@H](CC1)c2ccccc2 Molport-047-932-809 [1,1,0,0,0,0|2,0,0]=4 102 B14R2.68 N[C@H]1CC[C@@H](CC1)c2ccccc2 Molport-047-932-810 [1,1,0,0,0,0|2,0,0]=4 103 B14R2.68 N[C@H]1CC[C@H](CC1)c2ccccc2 Molport-047-932-807 [1,1,0,0,0,0|2,0,0]=4 104 B14R2.68 N[C@H]1CC[C@H](CC1)c2ccccc2 Molport-047-932-808 [1,1,0,0,0,0|2,0,0]=4 105 B14R2.68 Nc1ccc(cc1)C2CCCCC2 Molport-000-145-873 [1,1,0,0,0,0|2,0,0]=4 106 B14R2.68 Nc1ccc(cc1)C2CCCCC2 Molport-002-083-732 [1,1,0,0,0,0|2,0,0]=4 107 B14R2.68 OC1CCC(CC1)c2ccccc2 Molport-002-501-993 [1,1,0,0,0,0|2,0,0]=4 108 B14R2.68 O[C@H]1CC[C@@H](CC1)c2ccccc2 Molport-006-117-174 [1,1,0,0,0,0|2,0,0]=4 109 B14R2.68 O[C@H]1CC[C@H](CC1)c2ccccc2 Molport-006-118-657 [1,1,0,0,0,0|2,0,0]=4 110 B14R2.68 Oc1ccc(cc1)C2CCCCC2 Molport-000-153-767 [1,1,0,0,0,0|2,0,0]=4 111 B14R2.68 Sc1ccc(cc1)C2CCCCC2 Molport-005-238-281 [1,1,0,0,0,0|2,0,0]=4 112 B14R2.5540 OC1(CCCCC1)c2ccccc2 Molport-003-911-089 [1,1,0,0,0,0|2,0,0]=4 113 B14R2.10 CCc1cccc(c1)C2CCNC2 Molport-047-807-590 [0,1,0,0,1,0|2,0,0]=4 114 B14R2.10 OCc1cccc(n1)N2CCCC2 Molport-000-143-085 [0,1,0,0,1,0|2,0,0]=4 115 B14R2.10 OCc1ccnc(c1)N2CCCC2 Molport-000-143-550 [0,1,0,0,1,0|2,0,0]=4 116 B14R2.23 Cc1cccc(c1C)N2CCCC2 Molport-006-715-317 [0,1,0,0,1,0|1,0,0]=3 117 B14R2.23 Nc1c(ncnc1N2CCCC2)Cl Molport-002-005-748 [0,1,0,0,1,0|2,0,0]=4 118 B14R2.70 Cc1cc(ccc1F)C2CCCC2 Molport-047-968-935 [0,1,0,0,1,0|2,0,0]=4 119 B14R2.249 Clc1cc(nc(n1)N2CCCC2)Cl Molport-011-180-343 [0,1,0,0,1,0|2,0,0]=4 120 B14R2.249 Nc1cc(nc(n1)N2CCCC2)Cl Molport-016-631-147 [0,1,0,0,1,0|2,0,0]=4 121 B14R2.269 Cc1cccc(c1)[C@@H]2CCC[C@H]2O Molport-035-766-065 [0,1,0,0,1,0|2,0,0]=4 122 B14R2.4471 Cc1cccc(c1)C2(CCCC2)N Molport-008-512-966 [0,1,0,0,1,0|2,0,0]=4 123 B14R2.4471 Cc1cccc(c1)C2(CCCC2)O Molport-011-910-764 [0,1,0,0,1,0|2,0,0]=4 124 B16R2.35 Cc1c(cccc1NC2CCCCC2)Cl Molport-005-190-971 [0,1,0,0,0,1|2,0,0]=4 125 B16R2.124 Clc1cc(ccc1Br)CC2CCCCC2 Molport-047-970-349 [0,1,0,0,0,1|2,0,0]=4 126 B16R2.131 CN1CCC(CC1)Cc2ccnc(c2)Cl Molport-052-057-945 [0,1,0,0,0,1|2,0,0]=4 127 B16R2.131 CN1CCC(CC1)Nc2cccc(c2)N Molport-009-053-850 [0,1,0,0,0,1|2,0,0]=4 128 B16R2.131 CN1CCC(CC1)Oc2ccnc(c2)Cl Molport-020-552-786 [0,1,0,0,0,1|2,0,0]=4 129 B16R2.131 CN1CCN(CC1)Cc2cccc(c2)O Molport-016-584-516 [0,1,0,0,0,1|1,0,0]=3 130 B16R2.131 CN1CCN(CC1)Cc2cccc(c2)S Molport-035-780-679 [0,1,0,0,0,1|1,0,0]=3 131 B16R2.131 OC1CCC(CC1)Cc2cccc(c2)Cl Molport-046-674-143 [0,1,0,0,0,1|2,0,0]=4 132 B16R2.236 NC(C1CCCCC1)c2cccc(c2)Cl Molport-008-659-199 [0,1,0,0,0,1|2,0,0]=4 133 B16R2.236 OC(C1CCCCC1)c2cccc(c2)Cl Molport-008-659-582 [0,1,0,0,0,1|2,0,0]=4 134 B16R2.11896 NC1(CCCCC1)Cc2cccc(c2)Cl Molport-003-735-341 [0,1,0,0,0,1|2,0,0]=4 135 B16R2.175 CN1CCN(CC1)c2cccc(c2)CN Molport-000-143-057 [0,2,0,0,0,0|1,0,0]=3 136 B16R2.175 CN1CCN(CC1)c2cccc(c2)CO Molport-006-390-473 [0,2,0,0,0,0|1,0,0]=3 137 B16R2.175 CN1CCN(CC1)c2cncc(c2)CN Molport-039-203-813 [0,2,0,0,0,0|2,0,0]=4 138 B16R2.79341 CN1CCN(CC1)c2cc(cc(c2)N)C Molport-029-939-314 [0,2,0,0,0,0|1,0,0]=3 139 B16R2.79341 CN1CCN(CC1)c2nc(cc(n2)Cl)Cl Molport-011-180-342 [0,2,0,0,0,0|2,0,0]=4 140 B16R2.127 CN1CCC(CC1)(O)c2cccc(c2)Cl Molport-011-693-892 [0,2,0,0,0,0|1,0,0]=3 141 B16R2.127 CN1CCC(CC1)(O)c2cccc(c2)F Molport-013-054-381 [0,2,0,0,0,0|1,1,0]=4 142 B16R2.127 CN1CCC(CC1)(O)c2cccc(n2)Cl Molport-028-950-751 [0,2,0,0,0,0|2,0,0]=4 143 B16R2.2864 CN1CCN(CC1)c2ccc(c(c2)C)N Molport-000-490-374 [0,2,0,0,0,0|1,0,0]=3 144 B16R2.2864 CN1CCN(CC1)c2ccc(c(c2)N)C Molport-008-547-442 [0,2,0,0,0,0|1,0,0]=3 145 B16R2.2867 CN1CCN(CC1)c2cccc(c2N)C Molport-029-534-230 [0,2,0,0,0,0|1,0,0]=3 146 B16R2.2867 CN1CCN(CC1)c2ncnc(c2N)Cl Molport-001-888-187 [0,2,0,0,0,0|2,0,0]=4 147 B16R2.7941 NCC1(CCCCC1)c2cccc(c2)Cl Molport-039-240-244 [0,2,0,0,0,0|2,0,0]=4 148 B14R2.716 Cc1cccc(n1)NC2CCNC2 Molport-013-631-094 [0,0,1,1,0,0|2,0,0]=4 149 B14R2.716 Cc1cccc(n1)NC2CCNC2 Molport-051-485-779 [0,0,1,1,0,0|2,0,0]=4 150 B14R2.5637 CN1CCNCc2c1nc(cc2)C Molport-029-418-362 [0,0,1,1,0,0|2,0,0]=4 151 B12R2.2 C1CCC(C1)c2cccnc2 Molport-021-875-965 [1,0,0,0,1,0|2,0,0]=4 152 B12R2.2 C1CN(CCN1)c2cncs2 Molport-051-780-424 [1,0,0,0,1,0|2,0,0]=4 153 B14R2.6 C1CCC(CC1)Nc2ccccc2 Molport-000-002-847 [1,0,0,0,0,1|2,0,0]=4 154 B14R2.6 C1CCC(CC1)Nc2ccccc2 Molport-001-756-925 [1,0,0,0,0,1|2,0,0]=4 155 B14R2.6 C1CCC(CC1)Oc2ccccc2 Molport-000-880-855 [1,0,0,0,0,1|2,0,0]=4