0 B9R1.48 CC1CCCCC(=O)C1 Molport-021-278-709 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.48 C[C@@H]1CCCCC(=O)C1 Molport-047-642-438 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.48 O=C1CCCCC(=O)C1 Molport-003-935-599 [0,0,0,0,0,0|1,0,0]=1 3 B8R1.22 C=C1CCCCCC1 Molport-027-587-156 [1,0,0,0,0,0|2,0,1]=4 4 B8R1.22 NC1CCCCC=C1 Molport-004-802-356 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.162 COC1CCCCC(=O)C1 Molport-052-044-730 [0,1,0,0,0,0|1,0,2]=4 6 B10R1.276 CC1(CCCCC(=O)C1)C Molport-051-779-264 [0,1,0,0,0,0|2,0,1]=4 7 B10R1.276 FC1(CCCCC(=O)C1)F Molport-046-736-713 [0,1,0,0,0,0|2,0,1]=4 8 B10R2.42 O=C1NC(=O)C2C1CC2 Molport-038-384-109 [0,0,0,1,0,0|1,0,0]=2 9 B10R2.42 O=C1NC(=O)[C@H]2[C@@H]1CC2 Molport-009-194-630 [0,0,0,1,0,0|1,0,0]=2 10 B10R2.42 O=C1OC(=O)C2C1CC2 Molport-000-142-069 [0,0,0,1,0,0|0,0,0]=1 11 B10R2.61 O=C1CC2CC1CCC2 Molport-038-434-939 [0,0,0,1,0,0|2,0,1]=4 12 B10R2.61 O=C1NC2CC1CCC2 Molport-029-001-406 [0,0,0,1,0,0|2,0,1]=4 13 B10R2.61 O=C1N[C@@H]2C[C@H]1CCC2 Molport-035-853-847 [0,0,0,1,0,0|2,0,1]=4 14 B10R2.61 O=C1OC2CC1NCC2 Molport-029-509-923 [0,0,0,1,0,0|2,0,1]=4 15 B10R2.61 O=C1OC2CC1NCC2 Molport-047-944-283 [0,0,0,1,0,0|2,0,1]=4 16 B10R2.69 O=C1CCCC2CC2N1 Molport-052-044-620 [0,0,0,1,0,0|2,0,1]=4 17 B10R2.71 O=C1CC2CCC(C1)N2 Molport-000-001-372 [0,0,0,1,0,0|2,0,1]=4 18 B10R2.71 O=C1CC2CCC(C1)N2 Molport-003-849-635 [0,0,0,1,0,0|2,0,1]=4 19 B10R2.71 O=C1CC2CCC(C1)O2 Molport-020-001-211 [0,0,0,1,0,0|1,0,2]=4 20 B10R2.71 O=C1CC2CCC(C1)S2 Molport-042-605-437 [0,0,0,1,0,0|1,1,1]=4 21 B10R2.71 O=C1CC2CCC(C2)C1 Molport-022-878-923 [0,0,0,1,0,0|2,0,1]=4 22 B10R2.71 O=C1CC2CCC(C2)O1 Molport-051-771-129 [0,0,0,1,0,0|1,0,1]=3 23 B10R2.71 O=C1CC2CCN(C2)C1 Molport-051-780-579 [0,0,0,1,0,0|3,0,0]=4 24 B10R2.71 O=C1C[C@@H]2CC[C@H](C1)N2 Molport-009-767-824 [0,0,0,1,0,0|2,0,1]=4 25 B10R2.117 C[C@]12CCC[C@H]1C(=O)N2 Molport-038-387-562 [0,0,0,1,0,0|2,0,1]=4 26 B10R2.177 CC12CC1CCC(=O)C2 Molport-047-593-606 [0,0,0,1,0,0|2,0,1]=4 27 B8R1.4 CC1CCCC(=O)C1 Molport-001-793-304 [0,0,0,0,1,0|2,0,1]=4 28 B8R1.4 CC1CCOC(=O)O1 Molport-046-419-204 [0,0,0,0,1,0|2,0,1]=4 29 B8R1.4 C[C@@H]1CCCC(=O)C1 Molport-001-794-008 [0,0,0,0,1,0|2,0,1]=4 30 B8R1.4 C[C@H]1CCCC(=O)C1 Molport-019-999-069 [0,0,0,0,1,0|2,0,1]=4 31 B8R1.4 NC1CCCC(=O)C1 Molport-005-935-614 [0,0,0,0,1,0|2,0,1]=4 32 B8R1.4 NC1CCCC(=O)C1 Molport-035-775-872 [0,0,0,0,1,0|2,0,1]=4 33 B8R1.4 N[C@@H]1CCCC(=O)C1 Molport-051-995-140 [0,0,0,0,1,0|2,0,1]=4 34 B8R1.4 N[C@H]1CCCC(=O)C1 Molport-044-194-997 [0,0,0,0,1,0|2,0,1]=4 35 B8R1.4 O=C1CCCC(=O)C1 Molport-001-766-691 [0,0,0,0,1,0|1,0,0]=2 36 B8R1.4 OC1CCCC(=O)C1 Molport-025-703-325 [0,0,0,0,1,0|1,0,2]=4 37 B8R1.4 O[C@H]1CCCC(=O)C1 Molport-047-932-294 [0,0,0,0,1,0|1,0,2]=4 38 B8R1.5 CC1CCCCC1=O Molport-001-781-872 [0,0,0,0,1,0|1,0,1]=3 39 B8R1.5 C[C@H]1CCCCC1=O Molport-019-998-967 [0,0,0,0,1,0|1,0,1]=3 40 B8R1.5 OC1CCCCC1=C Molport-046-672-339 [0,0,0,0,1,0|1,0,2]=4 41 B8R1.5 OC1CCCCC1=C Molport-047-543-907 [0,0,0,0,1,0|1,0,2]=4 42 B8R1.5 OC1CCCCC1=O Molport-001-779-872 [0,0,0,0,1,0|0,0,2]=3 43 B10R1.71 O=C1CCC(=O)OCCO1 Molport-006-123-614 [0,0,0,0,0,1|3,0,0]=4 44 B10R1.77 O=C1CCCCCC(=O)C1 Molport-035-682-872 [0,0,0,0,0,1|1,0,0]=2 45 B7R1.24 C1CCC=CCC1 Molport-003-926-424 [2,0,0,0,0,0|1,0,1]=4 46 B9R1.5 CC1CCCCCC1=O Molport-014-212-811 [1,1,0,0,0,0|1,0,1]=4 47 B9R1.5 OC1CCCCCC1=O Molport-022-257-188 [1,1,0,0,0,0|1,0,1]=4 48 B9R1.49 CC1CCCC(=O)CC1 Molport-029-001-496 [1,1,0,0,0,0|1,0,1]=4 49 B9R1.49 FC1CCCC(=O)CC1 Molport-047-932-280 [1,1,0,0,0,0|1,0,1]=4 50 B9R1.34 CC1CC(=O)CC(=O)C1 Molport-000-870-627 [0,1,0,0,1,0|1,0,0]=3 51 B9R1.15 CCC1CCCCC1=O Molport-011-284-659 [0,1,0,0,1,0|1,0,1]=4 52 B9R1.15 CC[C@H]1CCCCC1=O Molport-051-570-693 [0,1,0,0,1,0|1,0,1]=4 53 B9R1.15 COC1CCCCC1=O Molport-001-793-388 [0,1,0,0,1,0|0,0,2]=4 54 B9R1.15 OCC1CCCCC1=O Molport-009-196-947 [0,1,0,0,1,0|0,0,2]=4 55 B9R1.40 CC1(CCCCC1=O)C Molport-001-787-675 [0,1,0,0,1,0|1,0,1]=4 56 B9R1.40 CC1(CCCCC1=O)O Molport-046-790-673 [0,1,0,0,1,0|0,0,2]=4 57 B11R1.497 CC(=O)C1CCCCC(=O)C1 Molport-028-988-021 [0,2,0,0,0,0|1,0,1]=4 58 B11R1.497 OC(=O)C1CCCCC(=O)C1 Molport-009-198-334 [0,2,0,0,0,0|1,0,1]=4 59 B9R1.22 CCC1CC(=O)OC1=O Molport-046-289-381 [0,0,1,1,0,0|0,0,0]=2 60 B9R1.13 CC(=O)OC1CCCO1 Molport-006-113-464 [0,0,1,1,0,0|0,0,2]=4 61 B9R1.38 CC1CC(=O)OC1(C)C Molport-039-033-256 [0,0,1,1,0,0|1,0,1]=4 62 B9R1.41 CC(=O)C1CCCC1=O Molport-001-790-293 [0,0,1,1,0,0|1,0,0]=3 63 B9R1.41 CC(=O)C1CCOC1=O Molport-001-793-371 [0,0,1,1,0,0|2,0,0]=4 64 B9R1.41 CC(=O)[C@@H]1CCOC1=O Molport-019-998-055 [0,0,1,1,0,0|2,0,0]=4 65 B9R1.37 CC1C(C(=O)NC1=O)C Molport-020-095-917 [0,0,1,1,0,0|1,0,0]=3 66 B9R1.37 CC1C(C(=O)OC1=O)C Molport-046-146-533 [0,0,1,1,0,0|0,0,0]=2 67 B9R1.125 CCC1(CCC(=O)O1)C Molport-047-359-145 [0,0,1,1,0,0|1,0,1]=4 68 B9R2.7 O=C1CC2C1NCC2 Molport-047-934-138 [1,0,0,1,0,0|2,0,0]=4 69 B9R2.7 O=C1CC2C1NCC2 Molport-047-934-139 [1,0,0,1,0,0|2,0,0]=4 70 B9R2.7 O=C1C[C@@H]2[C@@H]1CCC2 Molport-053-105-027 [1,0,0,1,0,0|1,0,1]=4 71 B9R2.7 O=C1C[C@H]2[C@@H]1OCC2 Molport-029-906-537 [1,0,0,1,0,0|2,0,0]=4 72 B9R2.7 O=C1NC2C1CCC2 Molport-000-000-513 [1,0,0,1,0,0|1,0,1]=4 73 B9R2.7 O=C1N[C@@H]2[C@H]1CCC2 Molport-009-755-250 [1,0,0,1,0,0|1,0,1]=4 74 B9R2.7 O=C1N[C@H]2[C@@H]1CCC2 Molport-039-140-541 [1,0,0,1,0,0|1,0,1]=4 75 B9R2.20 O=C1CCC2C1C=C2 Molport-046-855-776 [1,0,0,1,0,0|1,0,1]=4 76 B9R2.20 O=C1CC[C@@H]2[C@@H]1CC2 Molport-053-105-025 [1,0,0,1,0,0|1,0,1]=4 77 B9R2.20 O=C1NC[C@H]2[C@@H]1CC2 Molport-046-672-738 [1,0,0,1,0,0|1,0,1]=4 78 B9R2.20 O=C1OCC2C1CC2 Molport-046-831-842 [1,0,0,1,0,0|0,0,1]=3 79 B9R2.21 O=C1CC2CC2CN1 Molport-046-858-063 [1,0,0,1,0,0|1,0,1]=4 80 B9R2.21 O=C1CCC2CC2N1 Molport-029-001-067 [1,0,0,1,0,0|1,0,1]=4 81 B9R2.33 O=C1CC2CCC2C1 Molport-021-996-178 [1,0,0,1,0,0|1,0,1]=4 82 B9R2.33 O=C1CC2CCC2N1 Molport-046-791-158 [1,0,0,1,0,0|1,0,1]=4 83 B9R2.33 O=C1NC2CCC2O1 Molport-027-845-732 [1,0,0,1,0,0|1,0,1]=4 84 B9R2.109 O=C1CCCC2C1C2 Molport-019-998-898 [1,0,0,1,0,0|1,0,1]=4 85 B9R2.109 O=C1CCCC2C1O2 Molport-003-932-298 [1,0,0,1,0,0|2,0,0]=4 86 B9R2.109 O=C1CCC[C@H]2[C@@H]1C2 Molport-039-242-173 [1,0,0,1,0,0|1,0,1]=4 87 B9R2.109 O=C1CNCC2C1C2 Molport-036-380-236 [1,0,0,1,0,0|2,0,0]=4 88 B9R2.109 O=C1CNCC2C1C2 Molport-047-854-055 [1,0,0,1,0,0|2,0,0]=4 89 B9R2.109 O=C1COCC2C1C2 Molport-049-204-250 [1,0,0,1,0,0|2,0,0]=4 90 B9R2.109 O=C1NCCC2C1C2 Molport-029-657-696 [1,0,0,1,0,0|1,0,1]=4 91 B9R2.25 O=C1NC(=O)C2C1C2 Molport-002-888-005 [0,0,0,1,1,0|1,0,0]=3 92 B9R2.25 O=C1OC(=O)C2C1C2 Molport-001-757-212 [0,0,0,1,1,0|0,0,0]=2 93 B9R2.25 O=C1OC(=O)[C@H]2[C@@H]1C2 Molport-044-650-584 [0,0,0,1,1,0|0,0,0]=2 94 B9R2.19 O=C1CCC2CC1C2 Molport-035-679-166 [0,0,0,1,1,0|1,0,1]=4 95 B11R2.66 O=C1NCC2C1OC(=O)O2 Molport-046-142-028 [0,0,0,1,0,1|2,0,0]=4 96 B11R2.66 O[C@@H]1CC[C@@H]2[C@H]1OC(=O)C2 Molport-046-869-549 [0,0,0,1,0,1|0,0,2]=4 97 B11R2.202 O=C1OC(=O)C2C1CCC2 Molport-000-165-824 [0,0,0,1,0,1|0,0,0]=2 98 B11R2.202 O=C1OC(=O)[C@H]2[C@@H]1CCC2 Molport-005-942-541 [0,0,0,1,0,1|0,0,0]=2 99 B11R2.202 O=C1OC(=O)[C@H]2[C@@H]1COC2 Molport-047-772-119 [0,0,0,1,0,1|0,0,0]=2 100 B11R2.610 O=C1N[C@@H]2CC[C@@H]2C(=O)N1 Molport-009-194-598 [0,0,0,1,0,1|1,0,0]=3 101 B11R2.678 O=C1N[C@@H]2CCC[C@@H](C2)O1 Molport-047-932-412 [0,0,0,1,0,1|1,0,1]=4 102 B11R2.678 O=C1N[C@H]2CCC[C@H](C2)O1 Molport-046-932-848 [0,0,0,1,0,1|1,0,1]=4 103 B11R2.48 O=C1OC2CCC1CCC2 Molport-051-487-668 [0,1,0,1,0,0|1,0,1]=4 104 B11R2.201 O=C1CC(=O)C2CCC1C2 Molport-044-728-923 [0,1,0,1,0,0|1,0,0]=3 105 B11R2.201 O=C1NC(=O)C2CCC1N2 Molport-047-635-927 [0,1,0,1,0,0|1,0,0]=3 106 B11R2.201 O=C1OC(=O)C2CCC1C2 Molport-001-516-766 [0,1,0,1,0,0|0,0,0]=2 107 B11R2.201 O=C1OC(=O)C2CCC1O2 Molport-028-951-647 [0,1,0,1,0,0|0,0,0]=2 108 B11R2.201 O=C1OC(=O)C2CCC1S2 Molport-039-134-213 [0,1,0,1,0,0|0,0,0]=2 109 B11R2.201 O=C1OC(=O)[C@@H]2CC[C@H]1C2 Molport-035-769-859 [0,1,0,1,0,0|0,0,0]=2 110 B11R2.619 CC12CCC1C(=O)OC2=O Molport-047-636-892 [0,1,0,1,0,0|0,0,0]=2 111 B7R1.3 C=C1CCCCC1 Molport-001-781-923 [1,0,0,0,1,0|1,0,1]=4 112 B7R1.3 O=C1CCCCC1 Molport-000-871-993 [1,0,0,0,1,0|0,0,1]=3 113 B7R1.2 CC1=CC(=O)CC1 Molport-001-793-640 [0,0,0,0,2,0|2,0,0]=4 114 B7R1.2 CC1CCC(=O)O1 Molport-003-939-842 [0,0,0,0,2,0|1,0,1]=4 115 B7R1.2 C[C@@H]1CCC(=O)O1 Molport-003-932-892 [0,0,0,0,2,0|1,0,1]=4 116 B7R1.2 C[C@H]1CCC(=O)O1 Molport-028-949-582 [0,0,0,0,2,0|1,0,1]=4 117 B7R1.2 O=C1CCC(=O)C1 Molport-000-002-566 [0,0,0,0,2,0|1,0,0]=3 118 B7R1.2 O=C1CCC(=O)O1 Molport-000-871-978 [0,0,0,0,2,0|0,0,0]=2 119 B7R1.2 O=C1CNC(=O)C1 Molport-019-879-276 [0,0,0,0,2,0|2,0,0]=4 120 B7R1.2 O=C1COC(=O)C1 Molport-003-928-660 [0,0,0,0,2,0|2,0,0]=4 121 B7R1.2 OC1CCC(=O)O1 Molport-035-944-376 [0,0,0,0,2,0|0,0,2]=4 122 B7R1.4 CC1=CCCC1=O Molport-003-661-909 [0,0,0,0,2,0|1,0,1]=4 123 B7R1.4 CC1CCCC1=O Molport-001-793-641 [0,0,0,0,2,0|1,0,1]=4 124 B7R1.4 NC1CCCC1=O Molport-030-004-546 [0,0,0,0,2,0|1,0,1]=4 125 B7R1.4 O=C1CCOC1=O Molport-051-739-326 [0,0,0,0,2,0|1,0,0]=3 126 B7R1.4 OC1CCCC1=O Molport-022-878-815 [0,0,0,0,2,0|0,0,2]=4