0 B7R1.4 CN1CCCC1=N Molport-023-247-206 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.4 CN1CCCC1=O Molport-002-317-275 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.4 CN1CCCC1=S Molport-002-484-093 [0,0,0,0,0,0|2,1,0]=3 3 B7R1.4 FC1CCCC1=O Molport-029-000-968 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.4 FC1CCNC1=O Molport-044-184-465 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.4 FC1COCC1=O Molport-051-903-145 [0,0,0,0,0,0|4,0,0]=4 6 B7R1.4 F[C@@H]1CCNC1=O Molport-049-213-470 [0,0,0,0,0,0|3,0,0]=3 7 B7R1.4 F[C@H]1CCNC1=O Molport-051-615-606 [0,0,0,0,0,0|3,0,0]=3 8 B7R1.4 NC1CCCC1N Molport-033-355-782 [0,0,0,0,0,0|3,0,1]=4 9 B7R1.4 NN1CCCC1=O Molport-006-757-999 [0,0,0,0,0,0|1,0,0]=1 10 B7R1.4 NN1CCCC1=O Molport-007-994-778 [0,0,0,0,0,0|1,0,0]=1 11 B7R1.4 N[C@@H]1CCC[C@@H]1F Molport-039-060-653 [0,0,0,0,0,0|3,0,1]=4 12 B7R1.4 N[C@@H]1CCC[C@H]1F Molport-044-811-531 [0,0,0,0,0,0|3,0,1]=4 13 B7R1.4 N[C@@H]1CCC[C@H]1N Molport-039-062-189 [0,0,0,0,0,0|3,0,1]=4 14 B7R1.4 N[C@H]1CCC[C@@H]1F Molport-049-205-093 [0,0,0,0,0,0|3,0,1]=4 15 B7R1.4 N[C@H]1CCC[C@@H]1N Molport-004-802-120 [0,0,0,0,0,0|3,0,1]=4 16 B7R1.4 N[C@H]1CCC[C@@H]1N Molport-035-683-556 [0,0,0,0,0,0|3,0,1]=4 17 B7R1.4 N[C@H]1CCC[C@H]1F Molport-039-239-758 [0,0,0,0,0,0|3,0,1]=4 18 B7R1.4 N[C@H]1CCC[C@H]1N Molport-044-560-013 [0,0,0,0,0,0|3,0,1]=4 19 B7R1.4 N[C@H]1CCC[C@H]1N Molport-046-194-702 [0,0,0,0,0,0|3,0,1]=4 20 B7R1.4 O=C1CCCC1=O Molport-029-944-668 [0,0,0,0,0,0|3,0,0]=3 21 B6R1.2 CC1CCCO1 Molport-001-786-550 [1,0,0,0,0,0|2,0,1]=4 22 B6R1.2 CC1OCCO1 Molport-001-789-885 [1,0,0,0,0,0|2,0,1]=4 23 B6R1.2 CN1CCCC1 Molport-001-781-156 [1,0,0,0,0,0|2,0,1]=4 24 B6R1.2 CN1CCCC1 Molport-047-589-454 [1,0,0,0,0,0|2,0,1]=4 25 B6R1.2 CN1CCNC1 Molport-047-587-437 [1,0,0,0,0,0|2,0,1]=4 26 B6R1.2 CN1CCOC1 Molport-020-916-488 [1,0,0,0,0,0|1,0,1]=3 27 B6R1.2 N=C1CCCN1 Molport-005-310-923 [1,0,0,0,0,0|2,0,0]=3 28 B6R1.2 NC1CCCC1 Molport-000-871-509 [1,0,0,0,0,0|2,0,1]=4 29 B6R1.2 NC1CCNC1 Molport-001-795-080 [1,0,0,0,0,0|2,0,1]=4 30 B6R1.2 NC1CCNC1 Molport-002-343-989 [1,0,0,0,0,0|2,0,1]=4 31 B6R1.2 NC1CCOC1 Molport-001-794-861 [1,0,0,0,0,0|1,0,1]=3 32 B6R1.2 NC1CCOC1 Molport-009-197-833 [1,0,0,0,0,0|1,0,1]=3 33 B6R1.2 NN1CCCC1 Molport-003-937-362 [1,0,0,0,0,0|1,0,1]=3 34 B6R1.2 NN1CCCC1 Molport-003-984-627 [1,0,0,0,0,0|1,0,1]=3 35 B6R1.2 NN1CCCC1 Molport-035-789-526 [1,0,0,0,0,0|1,0,1]=3 36 B6R1.2 N[C@@H]1CCNC1 Molport-000-000-472 [1,0,0,0,0,0|2,0,1]=4 37 B6R1.2 N[C@@H]1CCNC1 Molport-001-768-446 [1,0,0,0,0,0|2,0,1]=4 38 B6R1.2 N[C@@H]1CCOC1 Molport-006-666-345 [1,0,0,0,0,0|1,0,1]=3 39 B6R1.2 N[C@@H]1CCOC1 Molport-009-680-802 [1,0,0,0,0,0|1,0,1]=3 40 B6R1.2 N[C@H]1CCNC1 Molport-000-000-473 [1,0,0,0,0,0|2,0,1]=4 41 B6R1.2 N[C@H]1CCNC1 Molport-001-768-445 [1,0,0,0,0,0|2,0,1]=4 42 B6R1.2 N[C@H]1CCOC1 Molport-001-768-755 [1,0,0,0,0,0|1,0,1]=3 43 B6R1.2 N[C@H]1CCOC1 Molport-005-937-196 [1,0,0,0,0,0|1,0,1]=3 44 B6R1.2 O=C1CCCN1 Molport-003-928-391 [1,0,0,0,0,0|1,0,0]=2 45 B6R1.2 O=C1CCOC1 Molport-006-708-377 [1,0,0,0,0,0|2,0,1]=4 46 B6R1.2 O=C1OCCO1 Molport-003-925-305 [1,0,0,0,0,0|1,0,0]=2 47 B6R1.2 S=C1CCCN1 Molport-001-762-079 [1,0,0,0,0,0|1,1,0]=3 48 B8R1.11 C=CN1CCCC1=O Molport-003-928-295 [0,1,0,0,0,0|2,0,0]=3 49 B8R1.11 C=CN1CCCC1=O Molport-019-994-713 [0,1,0,0,0,0|2,0,0]=3 50 B8R1.11 C=CN1CCCC1=O Molport-051-906-908 [0,1,0,0,0,0|2,0,0]=3 51 B8R1.11 CCN1CCCC1=O Molport-003-925-436 [0,1,0,0,0,0|2,0,0]=3 52 B8R1.11 CCN1CCCC1=O Molport-046-701-982 [0,1,0,0,0,0|2,0,0]=3 53 B8R1.11 NN1CCC[C@H]1CO Molport-035-757-998 [0,1,0,0,0,0|1,0,2]=4 54 B8R1.11 O=C1CCCC1C#N Molport-000-002-850 [0,1,0,0,0,0|2,0,1]=4 55 B8R1.11 O=C1OCCC1C#N Molport-004-361-151 [0,1,0,0,0,0|1,0,1]=3 56 B8R1.11 O=CN1CCCC1=O Molport-046-588-196 [0,1,0,0,0,0|2,0,0]=3 57 B8R1.11 OCN1CCCC1=O Molport-000-873-033 [0,1,0,0,0,0|2,0,0]=3 58 B8R1.18 CC1CN(C(=O)C1)C Molport-001-758-925 [0,1,0,0,0,0|2,0,0]=3 59 B8R1.18 CN1CC(CC1=O)N Molport-007-994-781 [0,1,0,0,0,0|2,0,0]=3 60 B8R1.18 CN1CC(CC1=O)N Molport-016-636-732 [0,1,0,0,0,0|2,0,0]=3 61 B8R1.18 CN1C[C@@H](CC1=O)N Molport-044-557-107 [0,1,0,0,0,0|2,0,0]=3 62 B8R1.18 CN1C[C@@H](CC1=O)N Molport-044-557-109 [0,1,0,0,0,0|2,0,0]=3 63 B8R1.18 CN1C[C@H](CC1=O)N Molport-042-684-132 [0,1,0,0,0,0|2,0,0]=3 64 B8R1.18 CN1C[C@H](CC1=O)N Molport-044-557-108 [0,1,0,0,0,0|2,0,0]=3 65 B8R1.18 NC1CC(=O)NC1=O Molport-006-169-094 [0,1,0,0,0,0|2,0,1]=4 66 B8R1.18 NC1CC(=O)NC1=O Molport-044-660-336 [0,1,0,0,0,0|2,0,1]=4 67 B8R1.18 N[C@@H]1CC(=O)NC1=O Molport-047-358-084 [0,1,0,0,0,0|2,0,1]=4 68 B8R1.18 N[C@@H]1CC(=O)NC1=O Molport-047-358-332 [0,1,0,0,0,0|2,0,1]=4 69 B8R1.18 N[C@H]1CC(=O)NC1=O Molport-008-541-701 [0,1,0,0,0,0|2,0,1]=4 70 B8R1.18 N[C@H]1CC(=O)NC1=O Molport-047-347-818 [0,1,0,0,0,0|2,0,1]=4 71 B8R1.19 FC1(CCNC1=O)F Molport-004-785-961 [0,1,0,0,0,0|3,0,0]=4 72 B8R1.50 CC1CCC(=O)N1C Molport-001-781-507 [0,1,0,0,0,0|2,0,0]=3 73 B8R1.50 CC1CCC(=O)N1N Molport-047-860-311 [0,1,0,0,0,0|1,0,0]=2 74 B8R1.50 CC1CCN(C1=O)C Molport-001-758-924 [0,1,0,0,0,0|2,0,0]=3 75 B8R1.50 CN1C(=O)CCC1=O Molport-000-385-147 [0,1,0,0,0,0|2,0,1]=4 76 B8R1.50 CN1CCC(=O)C1=O Molport-013-098-265 [0,1,0,0,0,0|2,0,0]=3 77 B8R1.50 CN1CCC(C1=O)N Molport-008-269-603 [0,1,0,0,0,0|2,0,0]=3 78 B8R1.50 CN1CCC(C1=O)N Molport-028-950-721 [0,1,0,0,0,0|2,0,0]=3 79 B8R1.50 CN1CC[C@@H](C1=O)N Molport-046-161-561 [0,1,0,0,0,0|2,0,0]=3 80 B8R1.50 CN1CC[C@@H](C1=O)N Molport-046-931-410 [0,1,0,0,0,0|2,0,0]=3 81 B8R1.50 CN1CC[C@H](C1=O)N Molport-046-934-791 [0,1,0,0,0,0|2,0,0]=3 82 B8R1.50 CN1CC[C@H](C1=O)N Molport-047-934-099 [0,1,0,0,0,0|2,0,0]=3 83 B8R1.50 NN1C(=O)CCC1=O Molport-028-749-800 [0,1,0,0,0,0|1,0,1]=3 84 B8R1.50 ON1C(=O)CCC1=O Molport-000-883-702 [0,1,0,0,0,0|2,0,1]=4 85 B8R1.50 ON1C(=O)CCC1=O Molport-039-139-920 [0,1,0,0,0,0|2,0,1]=4 86 B8R1.4 CN1CCCC(=O)C1 Molport-006-727-997 [0,0,0,0,0,1|2,0,0]=3 87 B8R1.4 CN1CCCC(=O)C1 Molport-027-950-775 [0,0,0,0,0,1|2,0,0]=3 88 B8R1.4 CN1CCCC(=O)C1 Molport-039-142-095 [0,0,0,0,0,1|2,0,0]=3 89 B8R1.4 CN1CCNC(=O)C1 Molport-019-879-257 [0,0,0,0,0,1|2,0,0]=3 90 B8R1.4 CN1CCOC(=O)C1 Molport-009-199-069 [0,0,0,0,0,1|1,0,0]=2 91 B8R1.5 FC1CCCCC1=O Molport-002-499-124 [0,0,0,0,0,1|3,0,0]=4 92 B8R1.5 F[C@@H]1CCCCC1=O Molport-046-774-733 [0,0,0,0,0,1|3,0,0]=4 93 B8R1.5 F[C@H]1CCCCC1=O Molport-046-767-456 [0,0,0,0,0,1|3,0,0]=4 94 B8R1.5 NC1CCCCC1=O Molport-019-878-553 [0,0,0,0,0,1|2,0,0]=3 95 B8R1.5 O=C1CCCCC1=O Molport-000-880-854 [0,0,0,0,0,1|3,0,0]=4 96 B5R1.1 C1CCOC1 Molport-000-871-942 [2,0,0,0,0,0|1,0,1]=4 97 B5R1.1 C1CCOC1 Molport-046-687-398 [2,0,0,0,0,0|1,0,1]=4 98 B5R1.1 C1COCO1 Molport-003-846-952 [2,0,0,0,0,0|1,0,1]=4 99 B7R0.7 CN(CCO)CC=C Molport-002-492-491 [0,1,1,0,0,0|2,0,0]=4 100 B7R1.1 NCC1CCOC1 Molport-000-140-229 [1,1,0,0,0,0|1,0,1]=4 101 B7R1.1 NCC1CCOC1 Molport-004-961-869 [1,1,0,0,0,0|1,0,1]=4 102 B7R1.1 NC[C@@H]1CCOC1 Molport-028-749-582 [1,1,0,0,0,0|1,0,1]=4 103 B7R1.1 NC[C@@H]1CCOC1 Molport-035-772-102 [1,1,0,0,0,0|1,0,1]=4 104 B7R1.1 NC[C@H]1CCOC1 Molport-028-749-578 [1,1,0,0,0,0|1,0,1]=4 105 B7R1.1 NC[C@H]1CCOC1 Molport-030-086-377 [1,1,0,0,0,0|1,0,1]=4 106 B7R1.1 NNC1CCOC1 Molport-011-133-114 [1,1,0,0,0,0|1,0,1]=4 107 B7R1.1 NNC1CCOC1 Molport-020-015-094 [1,1,0,0,0,0|1,0,1]=4 108 B7R1.1 NNC1CCOC1 Molport-035-683-678 [1,1,0,0,0,0|1,0,1]=4 109 B7R1.1 NN[C@@H]1CCOC1 Molport-046-156-880 [1,1,0,0,0,0|1,0,1]=4 110 B7R1.1 NN[C@@H]1CCOC1 Molport-047-345-849 [1,1,0,0,0,0|1,0,1]=4 111 B7R1.1 NN[C@H]1CCOC1 Molport-039-137-401 [1,1,0,0,0,0|1,0,1]=4 112 B7R1.1 NN[C@H]1CCOC1 Molport-046-937-533 [1,1,0,0,0,0|1,0,1]=4 113 B7R1.1 O/N=C/1\CCCN1 Molport-002-320-743 [1,1,0,0,0,0|1,0,1]=4 114 B7R1.1 O/N=C/1\CCCN1 Molport-046-701-958 [1,1,0,0,0,0|1,0,1]=4 115 B7R1.2 FC1COC(=O)O1 Molport-002-498-974 [1,1,0,0,0,0|1,0,0]=3 116 B7R1.2 F[C@H]1COC(=O)O1 Molport-051-570-814 [1,1,0,0,0,0|1,0,0]=3 117 B7R1.2 NN1CCC(C1)F Molport-039-198-256 [1,1,0,0,0,0|1,0,1]=4 118 B7R1.2 O=C1CCC(=O)N1 Molport-000-872-027 [1,1,0,0,0,0|1,0,1]=4 119 B9R1.34 CN1CC(=O)OC(=O)C1 Molport-020-552-944 [0,1,0,0,0,1|1,0,1]=4 120 B9R1.15 CNC1CCCCC1=O Molport-039-333-391 [0,1,0,0,0,1|2,0,0]=4 121 B9R1.22 CC1CN(C(=O)C1)C=C Molport-047-944-503 [0,2,0,0,0,0|2,0,0]=4 122 B9R1.22 CCN1CC(CC1=O)N Molport-029-997-421 [0,2,0,0,0,0|2,0,0]=4 123 B9R1.22 CCN1CC(CC1=O)O Molport-020-936-762 [0,2,0,0,0,0|2,0,0]=4 124 B9R1.22 CCN1C[C@H](CC1=O)O Molport-046-160-398 [0,2,0,0,0,0|2,0,0]=4 125 B9R1.33 C=CCN1CCCC1=O Molport-003-355-624 [0,2,0,0,0,0|2,0,0]=4 126 B9R1.33 CCCN1CCCC1=O Molport-003-984-632 [0,2,0,0,0,0|2,0,0]=4 127 B9R1.33 NCCN1CCCC1=O Molport-001-794-854 [0,2,0,0,0,0|1,0,0]=3 128 B9R1.33 NCCN1CCCC1=O Molport-003-991-541 [0,2,0,0,0,0|1,0,0]=3 129 B9R1.33 NCCN1CCCC1=O Molport-029-997-254 [0,2,0,0,0,0|1,0,0]=3 130 B9R1.33 O=C1CCCN1CC#C Molport-005-938-768 [0,2,0,0,0,0|2,0,0]=4 131 B9R1.33 O=C1CCCN1CC#N Molport-004-347-613 [0,2,0,0,0,0|1,0,1]=4 132 B9R1.33 OCCN1CCCC1=O Molport-001-791-455 [0,2,0,0,0,0|2,0,0]=4 133 B9R1.41 CC(=O)N1CCCC1=O Molport-002-501-706 [0,2,0,0,0,0|2,0,0]=4 134 B9R1.41 CC(C)N1CCCC1=O Molport-006-115-691 [0,2,0,0,0,0|2,0,0]=4 135 B9R1.41 CN(C)C1CCCC1=O Molport-038-950-211 [0,2,0,0,0,0|2,0,0]=4 136 B9R1.41 NC(=N)N1CCCC1=O Molport-002-320-217 [0,2,0,0,0,0|1,0,0]=3 137 B9R1.41 NC(=O)C1CCCC1=O Molport-019-999-507 [0,2,0,0,0,0|2,0,0]=4 138 B9R1.41 NC(=O)N1CCCC1=O Molport-001-992-125 [0,2,0,0,0,0|1,0,0]=3 139 B9R1.41 NN1CCC[C@@H]1C(=O)O Molport-001-761-355 [0,2,0,0,0,0|1,0,1]=4 140 B9R1.132 CC1CCN(C1=O)C=C Molport-047-913-796 [0,2,0,0,0,0|2,0,0]=4 141 B9R1.132 CCN1CCC(C1=O)N Molport-044-198-427 [0,2,0,0,0,0|2,0,0]=4 142 B9R1.132 CN1C(CCC1=O)C#N Molport-029-498-087 [0,2,0,0,0,0|2,0,0]=4 143 B9R1.132 CN1C(CCC1=O)CN Molport-016-631-638 [0,2,0,0,0,0|2,0,0]=4 144 B9R1.132 CN1C(CCC1=O)CN Molport-029-998-262 [0,2,0,0,0,0|2,0,0]=4 145 B9R1.132 CN1C(CCC1=O)CN Molport-051-913-489 [0,2,0,0,0,0|2,0,0]=4 146 B9R1.132 CN1CCC(C1=O)CN Molport-022-249-950 [0,2,0,0,0,0|2,0,0]=4 147 B9R1.132 CN1CCC(C1=O)CN Molport-044-562-715 [0,2,0,0,0,0|2,0,0]=4 148 B9R1.132 CN1[C@@H](CCC1=O)CN Molport-046-157-035 [0,2,0,0,0,0|2,0,0]=4 149 B9R1.132 CN1[C@H](CCC1=O)CN Molport-046-157-034 [0,2,0,0,0,0|2,0,0]=4 150 B9R1.132 CNC1CCN(C1=O)C Molport-038-948-145 [0,2,0,0,0,0|2,0,0]=4 151 B9R1.23 CN1CC(CC1=O)C#N Molport-004-774-808 [0,2,0,0,0,0|2,0,0]=4 152 B9R1.23 CN1CC(CC1=O)CN Molport-009-752-157 [0,2,0,0,0,0|2,0,0]=4 153 B9R1.23 CN1CC(CC1=O)CN Molport-035-385-697 [0,2,0,0,0,0|2,0,0]=4 154 B9R1.23 CN1CC(CC1=O)CN Molport-039-028-160 [0,2,0,0,0,0|2,0,0]=4 155 B9R1.23 CN1CC(CC1=O)CO Molport-009-196-944 [0,2,0,0,0,0|2,0,0]=4 156 B9R1.23 CN1C[C@H](CC1=O)CN Molport-046-161-133 [0,2,0,0,0,0|2,0,0]=4 157 B9R1.23 CN1C[C@H](CC1=O)CO Molport-047-977-555 [0,2,0,0,0,0|2,0,0]=4 158 B9R1.23 CNC1CN(C(=O)C1)C Molport-022-056-621 [0,2,0,0,0,0|2,0,0]=4 159 B7R1.3 O=C1COCCO1 Molport-003-986-736 [0,0,1,1,0,0|2,0,0]=4 160 B7R1.3 O=C1OCCCO1 Molport-003-922-561 [0,0,1,1,0,0|2,0,0]=4 161 B9R2.25 NC1=NC(=O)N2C1C2 Molport-003-941-779 [0,0,0,1,0,1|2,0,0]=4 162 B9R2.39 O=C1CN2CCC1C2 Molport-009-199-858 [0,0,0,1,0,1|2,0,0]=4 163 B9R2.39 O=C1CN2CCC1C2 Molport-023-279-355 [0,0,0,1,0,1|2,0,0]=4 164 B9R2.39 O=C1CN2CC[C@H]1C2 Molport-039-061-825 [0,0,0,1,0,1|2,0,0]=4 165 B9R1.48 CN1CCCNC(=O)C1 Molport-036-337-661 [0,0,0,0,0,2|2,0,0]=4 166 B9R1.49 CN1CCCC(=O)CC1 Molport-003-811-861 [0,0,0,0,0,2|2,0,0]=4 167 B9R1.49 CN1CCCC(=O)CC1 Molport-005-941-565 [0,0,0,0,0,2|2,0,0]=4 168 B9R1.49 CN1CCNC(=O)CC1 Molport-005-940-805 [0,0,0,0,0,2|2,0,0]=4 169 B9R1.49 CN1CCNC(=O)CC1 Molport-023-330-500 [0,0,0,0,0,2|2,0,0]=4 170 B9R1.5 NC1CCCCCC1=O Molport-038-950-077 [0,0,0,0,0,2|2,0,0]=4