0 B5R0.1 CCCN(C)C Molport-006-112-640 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.1 CN(C)CC#C Molport-001-785-479 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CN(C)CC=C Molport-003-925-486 [0,0,0,0,0,0|2,0,0]=2 3 B5R0.1 CN(C)CCF Molport-051-781-971 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.1 CN(C)CCN Molport-001-769-719 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.1 CN(C)CCN Molport-009-653-578 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.1 CN(C)CCN Molport-047-918-246 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.1 CN(C)CCN Molport-047-968-305 [0,0,0,0,0,0|2,0,1]=3 8 B4R0.1 CCN(C)C Molport-003-925-293 [1,0,0,0,0,0|1,0,1]=3 9 B4R0.1 CCN(C)C Molport-051-972-827 [1,0,0,0,0,0|1,0,1]=3 10 B6R0.1 CCN(C)CCN Molport-008-750-869 [0,1,0,0,0,0|2,0,1]=4 11 B6R0.1 CCN(C)CCN Molport-046-147-409 [0,1,0,0,0,0|2,0,1]=4 12 B6R0.2 CC(N)CN(C)C Molport-001-791-742 [0,1,0,0,0,0|2,0,1]=4 13 B6R0.2 CC(N)CN(C)C Molport-035-691-042 [0,1,0,0,0,0|2,0,1]=4 14 B6R0.2 CC(O)CN(C)C Molport-001-783-682 [0,1,0,0,0,0|1,0,2]=4 15 B6R0.2 CC(O)CN(C)C Molport-042-623-313 [0,1,0,0,0,0|1,0,2]=4 16 B6R0.2 CN(C)CC(=N)N Molport-016-634-644 [0,1,0,0,0,0|2,0,0]=3 17 B6R0.2 CN(C)CC(=N)N Molport-047-943-349 [0,1,0,0,0,0|2,0,0]=3 18 B6R0.2 CN(C)CC(=O)C Molport-001-793-984 [0,1,0,0,0,0|1,0,0]=2 19 B6R0.2 CN(C)CC(=O)N Molport-008-643-552 [0,1,0,0,0,0|1,0,0]=2 20 B6R0.2 CN(C)CC(=O)O Molport-001-792-053 [0,1,0,0,0,0|1,0,0]=2 21 B6R0.2 CN(C)CC(=O)O Molport-003-355-838 [0,1,0,0,0,0|1,0,0]=2 22 B6R0.2 CN(C)CC(=O)[O-] Molport-006-122-573 [0,1,0,0,0,0|1,0,0]=2 23 B6R0.2 CN(C)CN(C)C Molport-000-884-158 [0,1,0,0,0,0|3,0,0]=4 24 B6R0.2 C[C@@H](N)CN(C)C Molport-033-487-456 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.2 C[C@@H](N)CN(C)C Molport-046-931-303 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.2 C[C@@H](O)CN(C)C Molport-033-356-069 [0,1,0,0,0,0|1,0,2]=4 27 B6R0.2 C[C@H](N)CN(C)C Molport-033-483-934 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.2 C[C@H](N)CN(C)C Molport-038-948-662 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.2 C[C@H](O)CN(C)C Molport-003-933-716 [0,1,0,0,0,0|1,0,2]=4 30 B6R0.4 CCCCN(C)C Molport-003-931-157 [0,1,0,0,0,0|2,0,1]=4 31 B6R0.4 CN(C)CCC#C Molport-020-404-288 [0,1,0,0,0,0|2,0,1]=4 32 B6R0.4 CN(C)CCC#C Molport-029-939-382 [0,1,0,0,0,0|2,0,1]=4 33 B6R0.4 CN(C)CCCN Molport-001-791-758 [0,1,0,0,0,0|2,0,1]=4 34 B6R0.4 CN(C)CCCN Molport-047-589-368 [0,1,0,0,0,0|2,0,1]=4 35 B6R0.4 CN(C)CCCN Molport-047-659-943 [0,1,0,0,0,0|2,0,1]=4 36 B6R0.4 CN(C)CCCO Molport-001-768-954 [0,1,0,0,0,0|1,0,2]=4 37 B6R0.4 CN(C)CCCS Molport-026-522-658 [0,1,0,0,0,0|1,1,1]=4 38 B6R0.4 CN(C)CCCS Molport-046-688-130 [0,1,0,0,0,0|1,1,1]=4 39 B6R0.4 CN(C)CCNN Molport-003-762-436 [0,1,0,0,0,0|2,0,1]=4 40 B6R0.4 CN(C)CCNN Molport-006-704-068 [0,1,0,0,0,0|2,0,1]=4 41 B6R0.4 CN(C)CCNN Molport-047-156-107 [0,1,0,0,0,0|2,0,1]=4 42 B6R0.4 CN(C)CCON Molport-039-241-973 [0,1,0,0,0,0|1,0,2]=4 43 B6R0.4 CNCCN(C)C Molport-001-794-238 [0,1,0,0,0,0|2,0,1]=4 44 B6R0.4 CNCCN(C)C Molport-020-180-007 [0,1,0,0,0,0|2,0,1]=4 45 B6R0.4 CNCCN(C)C Molport-028-956-475 [0,1,0,0,0,0|2,0,1]=4 46 B6R0.4 COCCN(C)C Molport-018-617-161 [0,1,0,0,0,0|1,0,2]=4 47 B6R0.4 COCCN(C)C Molport-047-914-179 [0,1,0,0,0,0|1,0,2]=4 48 B6R0.4 CSCCN(C)C Molport-001-764-898 [0,1,0,0,0,0|1,1,1]=4 49 B6R0.4 CSCCN(C)C Molport-047-942-595 [0,1,0,0,0,0|1,1,1]=4 50 B6R1.2 CC1CCCC1 Molport-001-785-798 [0,0,0,1,0,0|1,0,1]=3 51 B6R1.2 CC1CCCO1 Molport-001-786-550 [0,0,0,1,0,0|2,0,1]=4 52 B6R1.2 CN1CCCC1 Molport-001-781-156 [0,0,0,1,0,0|2,0,1]=4 53 B6R1.2 CN1CCCC1 Molport-047-589-454 [0,0,0,1,0,0|2,0,1]=4 54 B6R1.2 CN1CCNC1 Molport-047-587-437 [0,0,0,1,0,0|2,0,1]=4 55 B6R1.2 CN1CCOC1 Molport-020-916-488 [0,0,0,1,0,0|1,0,2]=4 56 B6R1.2 FC1CCCC1 Molport-001-773-428 [0,0,0,1,0,0|2,0,1]=4 57 B6R1.2 FC1CCNC1 Molport-009-197-325 [0,0,0,1,0,0|2,0,1]=4 58 B6R1.2 FC1CCNC1 Molport-016-637-620 [0,0,0,1,0,0|2,0,1]=4 59 B6R1.2 F[C@@H]1CCNC1 Molport-000-155-955 [0,0,0,1,0,0|2,0,1]=4 60 B6R1.2 F[C@@H]1CCNC1 Molport-003-990-579 [0,0,0,1,0,0|2,0,1]=4 61 B6R1.2 F[C@H]1CCNC1 Molport-000-155-956 [0,0,0,1,0,0|2,0,1]=4 62 B6R1.2 F[C@H]1CCNC1 Molport-003-990-578 [0,0,0,1,0,0|2,0,1]=4 63 B6R1.2 NC1CCCC1 Molport-000-871-509 [0,0,0,1,0,0|2,0,1]=4 64 B6R1.2 NC1CCNC1 Molport-001-795-080 [0,0,0,1,0,0|2,0,1]=4 65 B6R1.2 NC1CCNC1 Molport-002-343-989 [0,0,0,1,0,0|2,0,1]=4 66 B6R1.2 NC1CCOC1 Molport-001-794-861 [0,0,0,1,0,0|1,0,2]=4 67 B6R1.2 NC1CCOC1 Molport-009-197-833 [0,0,0,1,0,0|1,0,2]=4 68 B6R1.2 N[C@@H]1CCNC1 Molport-000-000-472 [0,0,0,1,0,0|2,0,1]=4 69 B6R1.2 N[C@@H]1CCNC1 Molport-001-768-446 [0,0,0,1,0,0|2,0,1]=4 70 B6R1.2 N[C@@H]1CCOC1 Molport-006-666-345 [0,0,0,1,0,0|1,0,2]=4 71 B6R1.2 N[C@@H]1CCOC1 Molport-009-680-802 [0,0,0,1,0,0|1,0,2]=4 72 B6R1.2 N[C@H]1CCNC1 Molport-000-000-473 [0,0,0,1,0,0|2,0,1]=4 73 B6R1.2 N[C@H]1CCNC1 Molport-001-768-445 [0,0,0,1,0,0|2,0,1]=4 74 B6R1.2 N[C@H]1CCOC1 Molport-001-768-755 [0,0,0,1,0,0|1,0,2]=4 75 B6R1.2 N[C@H]1CCOC1 Molport-005-937-196 [0,0,0,1,0,0|1,0,2]=4 76 B6R1.2 SC1CCCC1 Molport-001-782-704 [0,0,0,1,0,0|2,0,1]=4 77 B6R1.3 CSCC1CO1 Molport-006-128-949 [0,0,0,1,0,0|3,0,0]=4 78 B6R1.3 N#CCC1CO1 Molport-051-721-111 [0,0,0,1,0,0|2,0,1]=4 79 B6R1.5 CN1CC(=O)C1 Molport-019-878-973 [0,0,0,1,0,0|1,0,0]=2 80 B6R1.5 CN1CC(=O)C1 Molport-044-182-885 [0,0,0,1,0,0|1,0,0]=2 81 B6R1.5 CN1CC(C1)N Molport-002-344-423 [0,0,0,1,0,0|2,0,1]=4 82 B6R1.5 CN1CC(C1)N Molport-015-164-284 [0,0,0,1,0,0|2,0,1]=4 83 B6R1.5 CN1CC(C1)N Molport-051-990-744 [0,0,0,1,0,0|2,0,1]=4 84 B3R0.2 CN(C)C Molport-000-883-876 [2,0,0,0,0,0|1,0,0]=3 85 B3R0.2 CN(C)C Molport-003-939-725 [2,0,0,0,0,0|1,0,0]=3 86 B3R0.2 CN(C)C Molport-051-610-872 [2,0,0,0,0,0|1,0,0]=3 87 B3R0.2 C[NH+](C)C Molport-006-114-731 [2,0,0,0,0,0|1,0,0]=3 88 B5R0.3 CCN(C)CC Molport-003-930-047 [1,1,0,0,0,0|1,0,1]=4 89 B7R0.2 CC(CN)CN(C)C Molport-003-749-713 [0,2,0,0,0,0|2,0,0]=4 90 B7R0.2 CC(CO)CN(C)C Molport-005-958-914 [0,2,0,0,0,0|2,0,0]=4 91 B7R0.2 CCN(C)CC(=O)C Molport-005-958-751 [0,2,0,0,0,0|1,0,0]=3 92 B7R0.2 CCN(C)CC(=O)O Molport-005-958-889 [0,2,0,0,0,0|1,0,0]=3 93 B7R0.2 CCN(C)CC(=O)O Molport-046-530-700 [0,2,0,0,0,0|1,0,0]=3 94 B7R0.2 CN(C)C/C(=N/O)/N Molport-005-933-234 [0,2,0,0,0,0|1,0,1]=4 95 B7R0.2 CN(C)C/C(=N/O)/N Molport-046-682-534 [0,2,0,0,0,0|1,0,1]=4 96 B7R0.2 CN(C)CC(=N)NO Molport-023-331-618 [0,2,0,0,0,0|1,0,1]=4 97 B7R0.2 CN[C@@H](C)CN(C)C Molport-047-800-548 [0,2,0,0,0,0|2,0,0]=4 98 B7R0.2 CN[C@H](C)CN(C)C Molport-047-781-898 [0,2,0,0,0,0|2,0,0]=4 99 B7R0.2 COC(=O)CN(C)C Molport-005-220-447 [0,2,0,0,0,0|1,0,0]=3 100 B7R0.2 COC(=O)CN(C)C Molport-023-220-021 [0,2,0,0,0,0|1,0,0]=3 101 B7R0.2 C[C@@H](CO)CN(C)C Molport-051-739-087 [0,2,0,0,0,0|2,0,0]=4 102 B7R0.2 C[C@H](CO)CN(C)C Molport-051-739-021 [0,2,0,0,0,0|2,0,0]=4 103 B7R0.7 CN(CCO)CC=C Molport-002-492-491 [0,2,0,0,0,0|2,0,0]=4 104 B7R0.11 CCCC(C)(C)CC Molport-003-894-772 [0,2,0,0,0,0|1,0,1]=4 105 B7R0.9 CN(C)CC(C)(C)C Molport-001-787-383 [0,2,0,0,0,0|2,0,0]=4 106 B7R0.9 CN(C)CC(C)(C)N Molport-000-003-543 [0,2,0,0,0,0|2,0,0]=4 107 B7R0.9 CN(C)CC(C)(C)N Molport-009-674-762 [0,2,0,0,0,0|2,0,0]=4 108 B7R0.9 CN(C)CC(C)(C)N Molport-027-719-613 [0,2,0,0,0,0|2,0,0]=4 109 B7R0.9 CN(C)CC(C)(C)O Molport-008-545-476 [0,2,0,0,0,0|2,0,0]=4 110 B7R0.9 CN(C)CC(C)(C)O Molport-039-240-333 [0,2,0,0,0,0|2,0,0]=4 111 B7R0.4 CN(C)CCCC=C Molport-051-996-392 [0,2,0,0,0,0|2,0,0]=4 112 B7R0.6 CN(C)CCC(=N)N Molport-016-634-913 [0,2,0,0,0,0|2,0,0]=4 113 B7R0.6 CN(C)CCC(=O)C Molport-002-485-442 [0,2,0,0,0,0|1,0,0]=3 114 B7R0.6 CN(C)CCC(=O)C Molport-005-907-601 [0,2,0,0,0,0|1,0,0]=3 115 B7R0.6 CN(C)CCC(=O)N Molport-008-643-575 [0,2,0,0,0,0|1,0,0]=3 116 B7R0.6 CN(C)CCC(=O)N Molport-046-702-768 [0,2,0,0,0,0|1,0,0]=3 117 B7R0.6 CN(C)CCC(=O)O Molport-001-790-337 [0,2,0,0,0,0|1,0,0]=3 118 B7R0.6 CN(C)CCC(=O)O Molport-016-580-608 [0,2,0,0,0,0|1,0,0]=3 119 B5R1.3 FCC1CO1 Molport-000-005-511 [1,0,0,1,0,0|2,0,0]=4 120 B5R1.1 C1CCCC1 Molport-001-789-854 [1,0,0,1,0,0|1,0,1]=4 121 B5R1.1 C1CCOC1 Molport-000-871-942 [1,0,0,1,0,0|0,0,2]=4 122 B5R1.1 C1CCOC1 Molport-046-687-398 [1,0,0,1,0,0|0,0,2]=4 123 B7R1.1 CCC1CCCC1 Molport-003-925-895 [0,1,0,1,0,0|1,0,1]=4 124 B7R1.1 CCC1CCNC1 Molport-013-776-827 [0,1,0,1,0,0|1,0,1]=4 125 B7R1.1 CCC1CCNC1 Molport-023-138-191 [0,1,0,1,0,0|1,0,1]=4 126 B7R1.1 CC[C@@H]1CCNC1 Molport-042-652-391 [0,1,0,1,0,0|1,0,1]=4 127 B7R1.1 CC[C@H]1CCNC1 Molport-042-652-392 [0,1,0,1,0,0|1,0,1]=4 128 B7R1.1 CNC1CCCC1 Molport-000-165-577 [0,1,0,1,0,0|1,0,1]=4 129 B7R1.1 CNC1CCCC1 Molport-002-344-424 [0,1,0,1,0,0|1,0,1]=4 130 B7R1.1 CNC1CCNC1 Molport-005-943-455 [0,1,0,1,0,0|1,0,1]=4 131 B7R1.1 CNC1CCNC1 Molport-005-943-603 [0,1,0,1,0,0|1,0,1]=4 132 B7R1.1 CNC1CCNC1 Molport-047-652-605 [0,1,0,1,0,0|1,0,1]=4 133 B7R1.1 CN[C@@H]1CCNC1 Molport-005-943-456 [0,1,0,1,0,0|1,0,1]=4 134 B7R1.1 CN[C@@H]1CCNC1 Molport-005-943-602 [0,1,0,1,0,0|1,0,1]=4 135 B7R1.1 CN[C@H]1CCNC1 Molport-005-943-457 [0,1,0,1,0,0|1,0,1]=4 136 B7R1.1 CN[C@H]1CCNC1 Molport-005-943-601 [0,1,0,1,0,0|1,0,1]=4 137 B7R1.1 COC1CCCC1 Molport-009-767-822 [0,1,0,1,0,0|1,0,1]=4 138 B7R1.1 CSC1CCCC1 Molport-036-369-900 [0,1,0,1,0,0|1,0,1]=4 139 B7R1.1 CSC1CCNC1 Molport-013-582-323 [0,1,0,1,0,0|1,0,1]=4 140 B7R1.1 CSC1CCNC1 Molport-039-240-006 [0,1,0,1,0,0|1,0,1]=4 141 B7R1.1 CS[C@@H]1CCNC1 Molport-047-770-609 [0,1,0,1,0,0|1,0,1]=4 142 B7R1.1 CS[C@@H]1CCNC1 Molport-047-970-726 [0,1,0,1,0,0|1,0,1]=4 143 B7R1.1 CS[C@H]1CCNC1 Molport-047-772-020 [0,1,0,1,0,0|1,0,1]=4 144 B7R1.1 FCC1CCNC1 Molport-029-078-459 [0,1,0,1,0,0|1,0,1]=4 145 B7R1.1 FCC1CCNC1 Molport-029-701-572 [0,1,0,1,0,0|1,0,1]=4 146 B7R1.1 FC[C@@H]1CCNC1 Molport-035-941-547 [0,1,0,1,0,0|1,0,1]=4 147 B7R1.1 FC[C@H]1CCNC1 Molport-046-935-138 [0,1,0,1,0,0|1,0,1]=4 148 B7R1.1 NCC1CCCC1 Molport-002-344-351 [0,1,0,1,0,0|1,0,1]=4 149 B7R1.1 NCC1CCCC1 Molport-003-732-830 [0,1,0,1,0,0|1,0,1]=4 150 B7R1.1 NCC1CCNC1 Molport-000-005-971 [0,1,0,1,0,0|1,0,1]=4 151 B7R1.1 NCC1CCNC1 Molport-023-223-810 [0,1,0,1,0,0|1,0,1]=4 152 B7R1.1 NCC1CCOC1 Molport-000-140-229 [0,1,0,1,0,0|0,0,2]=4 153 B7R1.1 NCC1CCOC1 Molport-004-961-869 [0,1,0,1,0,0|0,0,2]=4 154 B7R1.1 NC[C@@H]1CCOC1 Molport-028-749-582 [0,1,0,1,0,0|0,0,2]=4 155 B7R1.1 NC[C@@H]1CCOC1 Molport-035-772-102 [0,1,0,1,0,0|0,0,2]=4 156 B7R1.1 NC[C@H]1CCNC1 Molport-023-223-812 [0,1,0,1,0,0|1,0,1]=4 157 B7R1.1 NC[C@H]1CCNC1 Molport-046-148-590 [0,1,0,1,0,0|1,0,1]=4 158 B7R1.1 NC[C@H]1CCOC1 Molport-028-749-578 [0,1,0,1,0,0|0,0,2]=4 159 B7R1.1 NC[C@H]1CCOC1 Molport-030-086-377 [0,1,0,1,0,0|0,0,2]=4 160 B7R1.2 CN1CCC(=O)C1 Molport-009-198-135 [0,1,0,1,0,0|1,0,0]=3 161 B7R1.2 CN1CCC(=O)C1 Molport-027-949-208 [0,1,0,1,0,0|1,0,0]=3 162 B7R1.2 C[C@@H]1C[C@@H](CN1)F Molport-039-332-633 [0,1,0,1,0,0|1,0,1]=4 163 B7R1.2 C[C@@H]1C[C@H](CN1)F Molport-042-681-328 [0,1,0,1,0,0|1,0,1]=4 164 B7R1.2 C[C@H]1CC[C@H](C1)C Molport-006-114-338 [0,1,0,1,0,0|1,0,1]=4 165 B7R1.2 C[C@H]1C[C@@H](CN1)F Molport-051-477-987 [0,1,0,1,0,0|1,0,1]=4 166 B7R1.2 C[C@H]1C[C@H](CN1)F Molport-047-633-303 [0,1,0,1,0,0|1,0,1]=4 167 B7R1.2 FC1COC(=O)O1 Molport-002-498-974 [0,1,0,1,0,0|2,0,0]=4 168 B7R1.2 F[C@H]1COC(=O)O1 Molport-051-570-814 [0,1,0,1,0,0|2,0,0]=4 169 B7R1.3 CC1CCCCC1 Molport-001-785-800 [0,1,0,1,0,0|1,0,1]=4 170 B7R1.4 C[C@@H]1CNC[C@@H]1F Molport-039-332-635 [0,1,0,1,0,0|1,0,1]=4 171 B7R1.10 CN1CC(C1)CN Molport-019-879-015 [0,1,0,1,0,0|2,0,0]=4 172 B7R1.10 CN1CC(C1)CN Molport-035-748-733 [0,1,0,1,0,0|2,0,0]=4 173 B7R1.10 CNC1CN(C1)C Molport-002-053-774 [0,1,0,1,0,0|2,0,0]=4 174 B7R1.10 CNC1CN(C1)C Molport-006-701-029 [0,1,0,1,0,0|2,0,0]=4 175 B7R1.10 CNC1CN(C1)C Molport-028-616-450 [0,1,0,1,0,0|2,0,0]=4 176 B7R1.20 CN(C)CC1CC1 Molport-046-842-919 [0,1,0,1,0,0|2,0,0]=4 177 B7R1.26 CC(C)(F)C1CO1 Molport-046-241-024 [0,1,0,1,0,0|0,0,2]=4