0 B12R1.3862 CC(=O)NC1(CCCCC1)C#C Molport-002-745-253 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.3862 CC(=O)NC1(CCCCC1)C#N Molport-001-847-644 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.3862 CN(C)CC1(CCCCC1)CO Molport-008-751-798 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.3862 CN(C)CC1(CCCCC1)CO Molport-046-530-726 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.3862 CN(C)CC1(CCOCC1)CN Molport-046-688-179 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.3862 NC(=O)CC1(CCCCC1)C#N Molport-047-113-234 [0,0,0,0,0,0|1,0,2]=3 6 B12R1.3862 NC(=O)NC1(CCCCC1)C#C Molport-002-894-842 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.3862 NCC1(CCCCC1)CC(=O)N Molport-042-623-830 [0,0,0,0,0,0|1,0,0]=1 8 B12R1.3862 OC(=O)CC1(CCCCC1)C#N Molport-023-331-547 [0,0,0,0,0,0|0,0,2]=2 9 B11R1.928 CC(=O)NC1(CCCCC1)C Molport-000-900-557 [1,0,0,0,0,0|2,0,0]=3 10 B11R1.928 CN(C)CC1(CCCCC1)N Molport-004-409-242 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.928 NC(=O)CC1(CCCCC1)N Molport-044-730-215 [1,0,0,0,0,0|1,0,0]=2 12 B11R1.928 OC1(CCCCC1)C[N+](=O)[O-] Molport-001-781-760 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.1253 NCC1(CCCCC1)CC#N Molport-051-489-048 [1,0,0,0,0,0|1,0,1]=3 14 B13R1.4942 CNC1(CCCCC1)CC(=O)OC Molport-047-741-666 [0,1,0,0,0,0|2,0,0]=3 15 B13R1.4942 COC(=O)OC1(CCCCC1)C#C Molport-046-510-978 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.6672 CS(=O)(=O)NC1(CCCCC1)CN Molport-005-311-218 [0,1,0,0,0,0|2,0,1]=4 17 B13R1.6672 CS(=O)(=O)NC1(CCCCC1)CN Molport-011-983-384 [0,1,0,0,0,0|2,0,1]=4 18 B13R1.6672 NCC1(CCCCC1)CC(F)(F)F Molport-035-768-513 [0,1,0,0,0,0|2,0,1]=4 19 B13R1.8842 NC(=O)C1(CCCCC1)CC(=O)O Molport-051-903-271 [0,1,0,0,0,0|0,0,1]=2 20 B13R2.4014 O=C1CC2(CCCCC2)C(=O)N1 Molport-002-469-662 [0,0,0,1,0,0|2,0,1]=4 21 B13R2.4014 O=C1NC2(CCCCC2)C(=O)O1 Molport-035-765-627 [0,0,0,1,0,0|2,0,1]=4 22 B13R2.11128 O=C1CNCC2(N1)CCOCC2 Molport-047-770-067 [0,0,0,1,0,0|3,0,0]=4 23 B13R2.11462 O=S1(=O)CC2(CN1)CCOCC2 Molport-046-728-462 [0,0,0,1,0,0|2,0,1]=4 24 B11R1.1062 CCC1(CCCC1)NC(=O)C Molport-051-561-204 [0,0,0,0,1,0|3,0,0]=4 25 B11R1.1062 CN(C)CC1(CCCC1)CN Molport-008-751-283 [0,0,0,0,1,0|3,0,0]=4 26 B11R1.1074 CN(C)C1(CCCCC1)CN Molport-000-679-750 [0,0,0,0,1,0|3,0,0]=4 27 B11R1.1074 CN(C)C1(CCCCC1)CN Molport-016-583-089 [0,0,0,0,1,0|3,0,0]=4 28 B11R1.1074 CNC1(CCCCC1)C(=O)N Molport-011-903-499 [0,0,0,0,1,0|3,0,0]=4 29 B11R1.1074 CNC1(CCCCC1)C(=O)O Molport-011-836-033 [0,0,0,0,1,0|2,0,0]=3 30 B11R1.1074 CNC1(CCCCC1)C(=O)O Molport-047-659-353 [0,0,0,0,1,0|2,0,0]=3 31 B11R1.1074 NC(=O)C1(CCCCC1)C#N Molport-004-767-996 [0,0,0,0,1,0|1,0,2]=4 32 B11R1.1074 NNC1(CCCCC1)C(=O)O Molport-047-769-595 [0,0,0,0,1,0|1,0,0]=2 33 B11R1.1074 OC(=O)C1(CCCCC1)C#C Molport-051-770-886 [0,0,0,0,1,0|1,0,1]=3 34 B11R1.1074 OC(=O)C1(CCCCC1)C#N Molport-004-769-112 [0,0,0,0,1,0|0,0,2]=3 35 B11R1.1074 OCC1(CCCCC1)[N+](=O)[O-] Molport-047-588-145 [0,0,0,0,1,0|2,0,1]=4 36 B10R0.122 COCCC(C)(C)CC(=O)O Molport-046-146-519 [1,0,1,0,0,0|1,0,0]=3 37 B10R1.18 CC(=O)CC1CCCCC1 Molport-006-110-572 [2,0,0,0,0,0|1,0,0]=3 38 B10R1.18 CC(=O)NC1CCCCC1 Molport-004-949-918 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.18 NC(=N)CC1CCCCC1 Molport-000-002-820 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.18 NC(=O)CC1CCCCC1 Molport-009-032-087 [2,0,0,0,0,0|1,0,0]=3 41 B10R1.18 NC(=O)NC1CCCCC1 Molport-001-765-303 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.18 OC(=O)C=C1CCCCC1 Molport-002-872-463 [2,0,0,0,0,0|0,0,2]=4 43 B10R1.18 OC(=O)CC1CCCCC1 Molport-001-770-051 [2,0,0,0,0,0|0,0,0]=2 44 B10R1.18 OC(=O)CC1COCCO1 Molport-022-797-296 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.18 OC(=O)CC1OCCCO1 Molport-028-935-923 [2,0,0,0,0,0|2,0,0]=4 46 B10R1.18 OC(=O)C[C@@H]1COCCO1 Molport-051-794-960 [2,0,0,0,0,0|2,0,0]=4 47 B10R1.18 OC(=O)C[C@H]1COCCO1 Molport-051-794-959 [2,0,0,0,0,0|2,0,0]=4 48 B10R1.18 OC(=O)NC1CCCCC1 Molport-018-561-637 [2,0,0,0,0,0|1,0,0]=3 49 B10R1.18 OC(=O)NC1CCCCC1 Molport-023-220-523 [2,0,0,0,0,0|1,0,0]=3 50 B10R1.377 NC1(CCCCC1)CC#C Molport-044-587-472 [2,0,0,0,0,0|1,0,1]=4 51 B10R1.487 CCC1(CCCCC1)CN Molport-013-430-870 [2,0,0,0,0,0|0,0,1]=3 52 B10R1.487 CNC1(CCCCC1)CN Molport-006-756-312 [2,0,0,0,0,0|1,0,1]=4 53 B10R1.487 CSC1(CCCCC1)CN Molport-044-436-124 [2,0,0,0,0,0|1,0,1]=4 54 B10R1.487 NCC1(CCCCC1)C#N Molport-022-592-088 [2,0,0,0,0,0|1,0,1]=4 55 B10R1.487 NCC1(CCCCC1)C#N Molport-042-684-014 [2,0,0,0,0,0|1,0,1]=4 56 B10R1.487 NCC1(CCCCC1)CN Molport-019-923-192 [2,0,0,0,0,0|1,0,0]=3 57 B12R1.3524 CC1(CCCCC1)NC(=O)CN Molport-012-508-942 [1,1,0,0,0,0|2,0,0]=4 58 B12R1.2279 COCCC1(CCCCC1)CN Molport-013-430-885 [1,1,0,0,0,0|0,0,1]=3 59 B12R1.3098 CN(C)C1(CCCCC1)C(=O)O Molport-011-886-396 [0,1,0,0,1,0|2,0,0]=4 60 B12R1.3098 NC(=O)C1(CCCCC1)C(=O)O Molport-023-282-279 [0,1,0,0,1,0|0,0,1]=3 61 B12R1.3098 OC(=O)C1(CCCCC1)C(=O)O Molport-001-816-071 [0,1,0,0,1,0|1,0,1]=4 62 B12R1.3098 OC(=O)C1(CCCCC1)C(F)F Molport-028-949-633 [0,1,0,0,1,0|1,0,0]=3 63 B12R1.3824 CN1CCC(CC1)(CN)C(=O)O Molport-051-698-582 [0,1,0,0,1,0|1,0,0]=3 64 B12R1.3861 CS(=O)(=O)C1(CCCCC1)CN Molport-042-605-540 [0,1,0,0,1,0|1,0,1]=4 65 B14R1.16404 CN(C)C1(CCCCC1)CCC(=O)O Molport-047-972-844 [0,1,0,0,0,1|2,0,0]=4 66 B14R1.16404 OC(=O)CCC1(CCCCC1)[N+](=O)[O-] Molport-000-711-108 [0,1,0,0,0,1|2,0,0]=4 67 B14R1.16294 COC(CC1(CCCCC1)CN)OC Molport-051-773-224 [0,2,0,0,0,0|0,0,2]=4 68 B14R1.19189 CCOC(=O)CC1(CCCCC1)C#N Molport-047-586-148 [0,2,0,0,0,0|0,0,2]=4 69 B14R1.19189 CCOC(=O)CC1(CCCCC1)NC Molport-020-058-372 [0,2,0,0,0,0|2,0,0]=4 70 B14R1.24969 COC1(CCCCC1)C(F)(F)C(=O)O Molport-045-992-795 [0,2,0,0,0,0|2,0,0]=4 71 B14R1.16771 CC(=O)NC1(CCCCC1)CC(=O)O Molport-002-678-864 [0,2,0,0,0,0|1,0,1]=4 72 B14R1.16771 CN(C)CC1(CCCCC1)CC(=O)O Molport-002-894-336 [0,2,0,0,0,0|0,0,0]=2 73 B14R1.16771 CN(C)CC1(CCCCC1)CC(=O)O Molport-026-972-306 [0,2,0,0,0,0|0,0,0]=2 74 B14R1.16771 CN(C)CC1(CCOCC1)CC(=O)O Molport-047-828-119 [0,2,0,0,0,0|1,0,0]=3 75 B14R1.16771 OC(=O)CC1(CCCCC1)CC(=O)O Molport-002-832-069 [0,2,0,0,0,0|1,0,0]=3 76 B12R1.4 CCC1CCC(CC1)CC(=O)O Molport-006-022-421 [0,0,1,1,0,0|1,0,0]=3 77 B12R1.4 COC1CCC(CC1)CC(=O)O Molport-003-658-774 [0,0,1,1,0,0|2,0,0]=4 78 B12R1.4 NC[C@H]1CC[C@@H](CC1)CC(=O)O Molport-035-766-244 [0,0,1,1,0,0|2,0,0]=4 79 B12R1.1392 OC(=O)CC1CCCCCCC1 Molport-006-022-422 [0,0,1,1,0,0|1,0,0]=3 80 B12R2.2918 O=C1CC2(CN1)CCCCC2 Molport-003-847-535 [1,0,0,1,0,0|1,0,0]=3 81 B12R2.2918 O=C1CC2(CN1)CCCNC2 Molport-020-095-916 [1,0,0,1,0,0|2,0,0]=4 82 B12R2.2918 O=C1CC2(CN1)CCCNC2 Molport-028-617-626 [1,0,0,1,0,0|2,0,0]=4 83 B12R2.2918 O=C1CC2(CN1)CCCOC2 Molport-024-726-413 [1,0,0,1,0,0|2,0,0]=4 84 B12R2.2918 O=C1CC2(CN1)CCNCC2 Molport-008-154-349 [1,0,0,1,0,0|2,0,0]=4 85 B12R2.2918 O=C1CC2(CN1)CCNCC2 Molport-019-931-061 [1,0,0,1,0,0|2,0,0]=4 86 B12R2.2918 O=C1CC2(CN1)CCNCC2 Molport-023-194-932 [1,0,0,1,0,0|2,0,0]=4 87 B12R2.2918 O=C1CC2(CN1)CCNCC2 Molport-029-997-798 [1,0,0,1,0,0|2,0,0]=4 88 B12R2.2918 O=C1CC2(CN1)CCOCC2 Molport-020-095-901 [1,0,0,1,0,0|2,0,0]=4 89 B12R2.2918 O=C1CNC2(N1)CCCCC2 Molport-009-195-618 [1,0,0,1,0,0|2,0,0]=4 90 B12R2.2918 O=C1NC2(CO1)CCOCC2 Molport-027-130-362 [1,0,0,1,0,0|2,0,0]=4 91 B12R2.2918 OC1=NCC2(C1)CCCCC2 Molport-051-608-276 [1,0,0,1,0,0|1,0,0]=3 92 B12R2.5590 O=S1(=O)CC2(CCCC2)CN1 Molport-046-728-461 [0,0,0,1,1,0|1,0,1]=4 93 B12R2.4185 OC(=O)C1(CC2CC2C1)C#N Molport-046-024-225 [0,0,0,1,1,0|0,0,2]=4 94 B12R2.6473 OC(=O)C12CCN(CC1)CC2 Molport-009-198-099 [0,0,0,1,1,0|2,0,0]=4 95 B12R2.6473 OC(=O)C12CCN(CC1)CC2 Molport-027-836-744 [0,0,0,1,1,0|2,0,0]=4 96 B12R2.6473 OC(=O)[C@]12CCN(CC1)CC2 Molport-039-062-853 [0,0,0,1,1,0|2,0,0]=4 97 B14R2.31228 NC(=O)N1CCC2(C1)CCCCC2 Molport-046-855-410 [0,0,0,1,0,1|2,0,0]=4 98 B14R2.31228 OC(=O)C1CC2(CN1)CCSCC2 Molport-046-699-165 [0,0,0,1,0,1|1,0,0]=3 99 B14R2.31228 OC(=O)C1CC2(CO1)CCOCC2 Molport-046-698-679 [0,0,0,1,0,1|2,0,0]=4 100 B14R2.31228 OC(=O)C1CCC2(O1)CCOCC2 Molport-046-687-487 [0,0,0,1,0,1|2,0,0]=4 101 B14R2.55 NC(=O)C1CNCC12CCOCC2 Molport-047-141-121 [0,1,0,1,0,0|2,0,0]=4 102 B14R2.30027 O=C1CC2(CCCCC2)CC(=O)N1 Molport-001-796-751 [0,1,0,1,0,0|2,0,0]=4 103 B14R2.30027 O=C1CC2(CCSCC2)CC(=O)O1 Molport-047-359-029 [0,1,0,1,0,0|2,0,0]=4 104 B10R1.363 NC(=O)C1(CCCCC1)N Molport-004-330-656 [1,0,0,0,1,0|1,0,0]=3 105 B10R1.363 OC(=O)C1(CCCCC1)F Molport-001-773-083 [1,0,0,0,1,0|1,0,0]=3 106 B10R1.370 CC(=O)NC1(CCCC1)C Molport-019-996-781 [1,0,0,0,1,0|2,0,0]=4 107 B10R1.370 CC1(OCCO1)CC(=O)O Molport-001-002-139 [1,0,0,0,1,0|2,0,0]=4 108 B10R1.477 CNC1(CCCC1)C(=O)O Molport-011-835-989 [0,0,0,0,2,0|2,0,0]=4 109 B10R1.477 CNC1(CCCC1)C(=O)O Molport-029-997-876 [0,0,0,0,2,0|2,0,0]=4 110 B10R1.477 CNC1(CCCC1)C(=O)O Molport-051-773-828 [0,0,0,0,2,0|2,0,0]=4 111 B10R1.477 NCC1(CCCC1)C(=O)N Molport-011-725-246 [0,0,0,0,2,0|1,0,0]=3 112 B10R1.477 OC(=O)C1(CCCC1)C#C Molport-039-137-472 [0,0,0,0,2,0|1,0,1]=4 113 B10R1.477 OC(=O)C1(CCCC1)C#N Molport-002-469-854 [0,0,0,0,2,0|0,0,2]=4 114 B10R1.477 OC(=O)C1(CCOC1)CF Molport-029-130-079 [0,0,0,0,2,0|2,0,0]=4 115 B12R1.3845 CC(=O)NCC1(CCCC1)CO Molport-030-285-361 [0,0,0,0,1,1|2,0,0]=4