0 B6R0.1 CCN(C)CCN Molport-008-750-869 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.1 CCN(C)CCN Molport-046-147-409 [0,0,0,0,0,0|4,0,0]=4 2 B5R0.1 CCCN(C)C Molport-006-112-640 [1,0,0,0,0,0|3,0,0]=4 3 B5R0.3 CCN(C)CC Molport-003-930-047 [1,0,0,0,0,0|2,0,0]=3 4 B7R0.2 COC(=O)CN(C)C Molport-005-220-447 [0,1,0,0,0,0|3,0,0]=4 5 B7R0.2 COC(=O)CN(C)C Molport-023-220-021 [0,1,0,0,0,0|3,0,0]=4 6 B7R0.3 CCN(C)CCCN Molport-004-362-192 [0,1,0,0,0,0|3,0,0]=4 7 B7R0.3 CCN(C)CCCO Molport-005-958-924 [0,1,0,0,0,0|3,0,0]=4 8 B7R0.3 CCN(C)CCNC Molport-013-347-915 [0,1,0,0,0,0|3,0,0]=4 9 B7R0.7 CCCN(C)CCC Molport-003-935-673 [0,1,0,0,0,0|3,0,0]=4 10 B7R0.11 CCCC(C)(C)CC Molport-003-894-772 [0,1,0,0,0,0|2,0,1]=4 11 B7R1.1 CCC1CCCC1 Molport-003-925-895 [0,0,0,1,0,0|2,0,1]=4 12 B7R1.1 CCC1OCCO1 Molport-006-114-389 [0,0,0,1,0,0|0,0,2]=3 13 B7R1.1 COC1OCCO1 Molport-001-785-020 [0,0,0,1,0,0|1,0,2]=4 14 B7R1.1 NCC1CCCO1 Molport-001-759-275 [0,0,0,1,0,0|2,0,1]=4 15 B7R1.1 NCC1CCCO1 Molport-004-884-644 [0,0,0,1,0,0|2,0,1]=4 16 B7R1.1 NCC1OCCO1 Molport-001-794-458 [0,0,0,1,0,0|1,0,2]=4 17 B7R1.1 NC[C@@H]1CCCO1 Molport-001-794-503 [0,0,0,1,0,0|2,0,1]=4 18 B7R1.1 NC[C@@H]1CCCO1 Molport-042-622-147 [0,0,0,1,0,0|2,0,1]=4 19 B7R1.1 NC[C@H]1CCCO1 Molport-001-791-947 [0,0,0,1,0,0|2,0,1]=4 20 B7R1.1 NC[C@H]1CCCO1 Molport-039-239-976 [0,0,0,1,0,0|2,0,1]=4 21 B7R1.2 CN1CCC(=O)C1 Molport-009-198-135 [0,0,0,1,0,0|2,0,0]=3 22 B7R1.2 CN1CCC(=O)C1 Molport-027-949-208 [0,0,0,1,0,0|2,0,0]=3 23 B7R1.2 C[C@H]1CC[C@H](C1)C Molport-006-114-338 [0,0,0,1,0,0|2,0,1]=4 24 B7R1.2 FC1COC(=O)O1 Molport-002-498-974 [0,0,0,1,0,0|2,0,0]=3 25 B7R1.2 F[C@H]1COC(=O)O1 Molport-051-570-814 [0,0,0,1,0,0|2,0,0]=3 26 B7R1.2 O=C1CCC(=O)N1 Molport-000-872-027 [0,0,0,1,0,0|2,0,1]=4 27 B7R1.3 CC1CCCCC1 Molport-001-785-800 [0,0,0,1,0,0|2,0,1]=4 28 B7R1.3 CC1OCCCO1 Molport-035-868-679 [0,0,0,1,0,0|2,0,1]=4 29 B7R1.3 CN1CCCCC1 Molport-003-936-118 [0,0,0,1,0,0|3,0,0]=4 30 B7R1.3 FC1CCCCC1 Molport-000-155-560 [0,0,0,1,0,0|2,0,1]=4 31 B7R1.3 NC1CCCCC1 Molport-000-871-531 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.3 NC1CCCCC1 Molport-002-329-481 [0,0,0,1,0,0|2,0,1]=4 33 B7R1.3 NC1CCCCC1 Molport-003-915-276 [0,0,0,1,0,0|2,0,1]=4 34 B7R1.3 NC1CCCCC1 Molport-006-107-936 [0,0,0,1,0,0|2,0,1]=4 35 B7R1.3 O=C1COCCO1 Molport-003-986-736 [0,0,0,1,0,0|1,0,0]=2 36 B7R1.3 O=C1OCCCO1 Molport-003-922-561 [0,0,0,1,0,0|1,0,0]=2 37 B7R1.3 SC1CCCCC1 Molport-001-768-937 [0,0,0,1,0,0|1,1,1]=4 38 B7R1.3 [NH3+]C1CCCCC1 Molport-000-661-488 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.4 CN1CCCC1=N Molport-023-247-206 [0,0,0,1,0,0|3,0,0]=4 40 B7R1.4 CN1CCCC1=O Molport-002-317-275 [0,0,0,1,0,0|2,0,0]=3 41 B7R1.4 CN1CCCC1=S Molport-002-484-093 [0,0,0,1,0,0|2,1,0]=4 42 B7R1.4 FC1CCCC1=O Molport-029-000-968 [0,0,0,1,0,0|2,0,0]=3 43 B7R1.4 FC1CCNC1=O Molport-044-184-465 [0,0,0,1,0,0|2,0,0]=3 44 B7R1.4 FC1COCC1=O Molport-051-903-145 [0,0,0,1,0,0|3,0,0]=4 45 B7R1.4 F[C@@H]1CCNC1=O Molport-049-213-470 [0,0,0,1,0,0|2,0,0]=3 46 B7R1.4 F[C@H]1CCNC1=O Molport-051-615-606 [0,0,0,1,0,0|2,0,0]=3 47 B7R1.4 NN1CCCC1=O Molport-006-757-999 [0,0,0,1,0,0|3,0,0]=4 48 B7R1.4 NN1CCCC1=O Molport-007-994-778 [0,0,0,1,0,0|3,0,0]=4 49 B7R1.4 O=C1CCCC1=O Molport-029-944-668 [0,0,0,1,0,0|2,0,1]=4 50 B4R0.1 CCN(C)C Molport-003-925-293 [2,0,0,0,0,0|2,0,0]=4 51 B4R0.1 CCN(C)C Molport-051-972-827 [2,0,0,0,0,0|2,0,0]=4 52 B6R0.2 CN(C)CC(=O)C Molport-001-793-984 [1,1,0,0,0,0|2,0,0]=4 53 B6R0.8 CCC(C)(C)CC Molport-002-501-967 [1,1,0,0,0,0|1,0,1]=4 54 B8R0.5 CCOC(=O)CN(C)C Molport-001-785-870 [0,2,0,0,0,0|0,0,0]=2 55 B8R0.9 COC(=O)CCN(C)C Molport-003-928-485 [0,2,0,0,0,0|2,0,0]=4 56 B8R0.13 CCC(=O)C(C)(C)CC Molport-033-481-633 [0,2,0,0,0,0|1,0,0]=3 57 B8R0.13 CCC(C)(C)C(=O)CN Molport-051-778-105 [0,2,0,0,0,0|2,0,0]=4 58 B6R1.2 CC1CCCO1 Molport-001-786-550 [1,0,0,1,0,0|1,0,1]=4 59 B6R1.2 CC1OCCO1 Molport-001-789-885 [1,0,0,1,0,0|0,0,2]=4 60 B6R1.2 N=C1CCCN1 Molport-005-310-923 [1,0,0,1,0,0|2,0,0]=4 61 B6R1.2 O=C1CCCN1 Molport-003-928-391 [1,0,0,1,0,0|1,0,0]=3 62 B6R1.2 O=C1CCOC1 Molport-006-708-377 [1,0,0,1,0,0|2,0,0]=4 63 B6R1.2 O=C1OCCO1 Molport-003-925-305 [1,0,0,1,0,0|1,0,0]=3 64 B6R1.2 S=C1CCCN1 Molport-001-762-079 [1,0,0,1,0,0|1,1,0]=4 65 B6R1.5 CN1CC(=O)C1 Molport-019-878-973 [1,0,0,1,0,0|2,0,0]=4 66 B6R1.5 CN1CC(=O)C1 Molport-044-182-885 [1,0,0,1,0,0|2,0,0]=4 67 B6R1.1 C1CCCCC1 Molport-001-785-799 [1,0,0,1,0,0|1,0,1]=4 68 B6R1.1 C1COC=CO1 Molport-009-681-042 [1,0,0,1,0,0|1,0,1]=4 69 B6R1.1 C1COCCO1 Molport-001-785-778 [1,0,0,1,0,0|1,0,1]=4 70 B6R1.1 C1COCCO1 Molport-001-786-851 [1,0,0,1,0,0|1,0,1]=4 71 B6R1.1 C1COCCO1 Molport-027-838-000 [1,0,0,1,0,0|1,0,1]=4 72 B6R1.1 C1COCOC1 Molport-003-929-185 [1,0,0,1,0,0|1,0,1]=4 73 B8R1.1 CC1CCC(O1)C#N Molport-024-242-115 [0,1,0,1,0,0|1,0,1]=4 74 B8R1.1 CCC1CCC(=O)N1 Molport-019-879-554 [0,1,0,1,0,0|1,0,0]=3 75 B8R1.1 CCN1CCC(=O)C1 Molport-012-626-279 [0,1,0,1,0,0|1,0,0]=3 76 B8R1.1 CC[C@H]1CCC(=O)N1 Molport-051-783-778 [0,1,0,1,0,0|1,0,0]=3 77 B8R1.1 FCC1COC(=O)O1 Molport-029-701-717 [0,1,0,1,0,0|1,0,0]=3 78 B8R1.1 NCC1CCC(=O)N1 Molport-000-000-968 [0,1,0,1,0,0|1,0,0]=3 79 B8R1.1 NCC1CCC(=O)N1 Molport-006-703-171 [0,1,0,1,0,0|1,0,0]=3 80 B8R1.1 NCC1CCC(=O)N1 Molport-029-998-261 [0,1,0,1,0,0|1,0,0]=3 81 B8R1.1 NCC1COC(=O)O1 Molport-046-071-708 [0,1,0,1,0,0|1,0,0]=3 82 B8R1.1 NC[C@@H]1CCC(=O)N1 Molport-000-000-969 [0,1,0,1,0,0|1,0,0]=3 83 B8R1.1 NC[C@@H]1CCC(=O)N1 Molport-042-622-805 [0,1,0,1,0,0|1,0,0]=3 84 B8R1.1 NC[C@@H]1COC(=O)O1 Molport-046-837-730 [0,1,0,1,0,0|1,0,0]=3 85 B8R1.1 NC[C@H]1CCC(=O)N1 Molport-000-000-970 [0,1,0,1,0,0|1,0,0]=3 86 B8R1.1 NC[C@H]1CCC(=O)N1 Molport-027-947-865 [0,1,0,1,0,0|1,0,0]=3 87 B8R1.1 NC[C@H]1COC(=O)O1 Molport-046-831-512 [0,1,0,1,0,0|1,0,0]=3 88 B8R1.4 CN1CCCC(=O)C1 Molport-006-727-997 [0,1,0,1,0,0|1,0,0]=3 89 B8R1.4 CN1CCCC(=O)C1 Molport-027-950-775 [0,1,0,1,0,0|1,0,0]=3 90 B8R1.4 CN1CCCC(=O)C1 Molport-039-142-095 [0,1,0,1,0,0|1,0,0]=3 91 B8R1.4 CN1CCNC(=O)C1 Molport-019-879-257 [0,1,0,1,0,0|1,0,0]=3 92 B8R1.4 CN1CCOC(=O)C1 Molport-009-199-069 [0,1,0,1,0,0|0,0,0]=2 93 B8R1.18 CC1CN(C(=O)C1)C Molport-001-758-925 [0,1,0,1,0,0|2,0,0]=4 94 B8R1.18 CN1CC(CC1=O)N Molport-007-994-781 [0,1,0,1,0,0|2,0,0]=4 95 B8R1.18 CN1CC(CC1=O)N Molport-016-636-732 [0,1,0,1,0,0|2,0,0]=4 96 B8R1.18 CN1C[C@@H](CC1=O)N Molport-044-557-107 [0,1,0,1,0,0|2,0,0]=4 97 B8R1.18 CN1C[C@@H](CC1=O)N Molport-044-557-109 [0,1,0,1,0,0|2,0,0]=4 98 B8R1.18 CN1C[C@H](CC1=O)N Molport-042-684-132 [0,1,0,1,0,0|2,0,0]=4 99 B8R1.18 CN1C[C@H](CC1=O)N Molport-044-557-108 [0,1,0,1,0,0|2,0,0]=4 100 B8R1.18 FC1OC(=O)OC1F Molport-046-165-330 [0,1,0,1,0,0|2,0,0]=4 101 B8R1.18 F[C@H]1OC(=O)O[C@@H]1F Molport-046-165-332 [0,1,0,1,0,0|2,0,0]=4 102 B8R1.51 CC1(CCC(=N)N1)C Molport-039-240-653 [0,1,0,1,0,0|2,0,0]=4 103 B8R1.51 CC1(CCC(=O)N1)C Molport-001-781-508 [0,1,0,1,0,0|1,0,0]=3 104 B8R1.2 NCC1=COCCO1 Molport-016-636-853 [0,1,0,1,0,0|1,0,1]=4 105 B8R1.2 ON=C1CCCCC1 Molport-000-872-080 [0,1,0,1,0,0|1,0,1]=4 106 B8R1.3 CN1CCC(=O)CC1 Molport-000-146-213 [0,1,0,1,0,0|1,0,0]=3 107 B8R1.3 CN1CCC(=O)CC1 Molport-005-935-360 [0,1,0,1,0,0|1,0,0]=3 108 B8R1.3 FC1CCC(=O)CC1 Molport-019-878-583 [0,1,0,1,0,0|1,0,0]=3 109 B8R1.5 FC1CCCCC1=O Molport-002-499-124 [0,1,0,1,0,0|1,0,0]=3 110 B8R1.5 F[C@@H]1CCCCC1=O Molport-046-774-733 [0,1,0,1,0,0|1,0,0]=3 111 B8R1.5 F[C@H]1CCCCC1=O Molport-046-767-456 [0,1,0,1,0,0|1,0,0]=3 112 B8R1.5 NC1CCCCC1=O Molport-019-878-553 [0,1,0,1,0,0|1,0,0]=3 113 B8R1.5 O=C1CCCCC1=O Molport-000-880-854 [0,1,0,1,0,0|1,0,0]=3 114 B8R1.22 C=C1COCCOC1 Molport-046-837-871 [0,1,0,1,0,0|2,0,0]=4 115 B8R1.22 O=C1CCCCCC1 Molport-001-769-691 [0,1,0,1,0,0|1,0,0]=3 116 B8R1.22 O=C1CCOCCO1 Molport-019-996-929 [0,1,0,1,0,0|0,0,0]=2 117 B8R1.22 O=C1COCCOC1 Molport-035-868-866 [0,1,0,1,0,0|1,0,0]=3 118 B8R1.50 CC1CCC(=O)N1C Molport-001-781-507 [0,1,0,1,0,0|1,0,0]=3 119 B8R1.50 CC1CCC(=O)N1N Molport-047-860-311 [0,1,0,1,0,0|1,0,0]=3 120 B8R1.50 CC1CCN(C1=O)C Molport-001-758-924 [0,1,0,1,0,0|1,0,0]=3 121 B8R1.50 CN1CCC(=O)C1=O Molport-013-098-265 [0,1,0,1,0,0|2,0,0]=4 122 B8R1.50 CN1CCC(C1=O)N Molport-008-269-603 [0,1,0,1,0,0|2,0,0]=4 123 B8R1.50 CN1CCC(C1=O)N Molport-028-950-721 [0,1,0,1,0,0|2,0,0]=4 124 B8R1.50 CN1CC[C@@H](C1=O)N Molport-046-161-561 [0,1,0,1,0,0|2,0,0]=4 125 B8R1.50 CN1CC[C@@H](C1=O)N Molport-046-931-410 [0,1,0,1,0,0|2,0,0]=4 126 B8R1.50 CN1CC[C@H](C1=O)N Molport-046-934-791 [0,1,0,1,0,0|2,0,0]=4 127 B8R1.50 CN1CC[C@H](C1=O)N Molport-047-934-099 [0,1,0,1,0,0|2,0,0]=4 128 B8R1.52 CCC1(CCOC1)N Molport-030-004-936 [0,1,0,1,0,0|1,0,1]=4 129 B8R1.52 CCC1(OCCO1)C Molport-003-930-579 [0,1,0,1,0,0|0,0,2]=4 130 B8R1.19 FC1(CCNC1=O)F Molport-004-785-961 [0,1,0,1,0,0|2,0,0]=4 131 B8R1.37 CCOC(=O)C1CO1 Molport-000-003-554 [0,1,0,1,0,0|0,0,0]=2 132 B8R1.37 CCOC(=O)[C@@H]1CO1 Molport-047-593-916 [0,1,0,1,0,0|0,0,0]=2 133 B8R1.37 CCOC(=O)[C@H]1CO1 Molport-019-903-563 [0,1,0,1,0,0|0,0,0]=2 134 B8R1.8 CCOC1CCCO1 Molport-003-927-803 [0,1,0,1,0,0|0,0,2]=4 135 B8R1.8 CCOC1CCNC1 Molport-003-993-173 [0,1,0,1,0,0|1,0,1]=4 136 B8R1.8 CCOC1CCNC1 Molport-008-601-388 [0,1,0,1,0,0|1,0,1]=4 137 B8R1.8 CCOC1CCNC1 Molport-029-997-907 [0,1,0,1,0,0|1,0,1]=4 138 B8R1.8 CCOC1CCNC1 Molport-035-689-909 [0,1,0,1,0,0|1,0,1]=4 139 B8R1.8 CCO[C@@H]1CCNC1 Molport-020-394-646 [0,1,0,1,0,0|1,0,1]=4 140 B8R1.8 CCO[C@@H]1CCNC1 Molport-028-957-663 [0,1,0,1,0,0|1,0,1]=4 141 B8R1.8 CCO[C@H]1CCNC1 Molport-027-834-931 [0,1,0,1,0,0|1,0,1]=4 142 B8R1.8 CCO[C@H]1CCNC1 Molport-035-683-429 [0,1,0,1,0,0|1,0,1]=4 143 B8R1.8 CNCC1CCCO1 Molport-001-785-993 [0,1,0,1,0,0|1,0,1]=4 144 B8R1.8 CNCC1CCCO1 Molport-046-508-623 [0,1,0,1,0,0|1,0,1]=4 145 B8R1.8 CNCC1OCCO1 Molport-001-792-692 [0,1,0,1,0,0|0,0,2]=4 146 B8R1.8 CNC[C@@H]1CCCO1 Molport-028-950-374 [0,1,0,1,0,0|1,0,1]=4 147 B8R1.8 CNC[C@H]1CCCO1 Molport-028-950-071 [0,1,0,1,0,0|1,0,1]=4 148 B8R1.8 NCCC1CCCO1 Molport-004-303-369 [0,1,0,1,0,0|1,0,1]=4 149 B8R1.8 NCCC1OCCO1 Molport-001-794-452 [0,1,0,1,0,0|0,0,2]=4 150 B8R1.8 NCC[C@H]1CCCO1 Molport-044-432-216 [0,1,0,1,0,0|1,0,1]=4 151 B8R1.8 OCCC1OCCO1 Molport-027-837-777 [0,1,0,1,0,0|0,0,2]=4 152 B8R1.11 CCN1CCCC1=O Molport-003-925-436 [0,1,0,1,0,0|1,0,0]=3 153 B8R1.11 CCN1CCCC1=O Molport-046-701-982 [0,1,0,1,0,0|1,0,0]=3 154 B8R1.11 O=C1CCCC1C#N Molport-000-002-850 [0,1,0,1,0,0|1,0,1]=4 155 B8R1.11 O=C1OCCC1C#N Molport-004-361-151 [0,1,0,1,0,0|0,0,1]=3 156 B8R1.11 OCN1CCCC1=O Molport-000-873-033 [0,1,0,1,0,0|2,0,0]=4