0 B7R0.4 C=CCNCC(C)C Molport-003-726-538 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.4 C=CCNCC(C)C Molport-009-676-786 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.4 CC(C)CCCCBr Molport-004-947-271 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.4 CC(C)CCCCN Molport-011-183-366 [0,0,0,0,0,0|3,0,0]=3 4 B7R0.4 CC(C)CCN=C=O Molport-003-748-801 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.4 CC(C)NCCCO Molport-002-344-315 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.4 CC(C)NCCCO Molport-029-906-630 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.4 CC(C)OCCCN Molport-001-791-504 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.4 CCCCNC(C)C Molport-004-896-242 [0,0,0,0,0,0|4,0,0]=4 9 B7R0.4 CCNCCN(C)C Molport-001-791-509 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.4 CN(C)CCN=C=O Molport-006-831-181 [0,0,0,0,0,0|3,0,0]=3 11 B7R0.4 CNCCCC(C)C Molport-013-283-622 [0,0,0,0,0,0|2,0,1]=3 12 B6R0.4 C#CCNC(C)C Molport-004-375-922 [1,0,0,0,0,0|3,0,0]=4 13 B6R0.4 CC(Br)CCC#N Molport-006-121-010 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.4 CC(C)CCCN Molport-004-308-245 [1,0,0,0,0,0|1,0,1]=3 15 B6R0.4 CC(C)CCON Molport-039-209-744 [1,0,0,0,0,0|0,0,1]=2 16 B6R0.4 CC(C)CN=C=O Molport-003-748-781 [1,0,0,0,0,0|2,0,0]=3 17 B6R0.4 CC(C)OCCBr Molport-002-465-553 [1,0,0,0,0,0|3,0,0]=4 18 B6R0.4 CC(C)OCCCl Molport-002-508-108 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.4 CC(C)OCCN Molport-001-794-460 [1,0,0,0,0,0|2,0,1]=4 20 B6R0.4 CC(C)OCCO Molport-001-791-402 [1,0,0,0,0,0|2,0,1]=4 21 B6R0.4 CC(C)SCCCl Molport-008-154-301 [1,0,0,0,0,0|3,0,0]=4 22 B6R0.4 CC(N)CCCN Molport-020-866-580 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.4 CCNCC(C)C Molport-005-312-382 [1,0,0,0,0,0|3,0,0]=4 24 B6R0.4 CN(C)CCC#N Molport-001-794-510 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.4 CN(C)CCCN Molport-001-791-758 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.4 CN(C)CCCO Molport-001-768-954 [1,0,0,0,0,0|2,0,1]=4 27 B6R0.4 CN(C)CCNN Molport-006-704-068 [1,0,0,0,0,0|2,0,1]=4 28 B6R0.4 CNCCN(C)C Molport-001-794-238 [1,0,0,0,0,0|2,0,1]=4 29 B6R0.6 CCCCCCBr Molport-001-783-750 [1,0,0,0,0,0|3,0,0]=4 30 B6R0.6 CCCCCCI Molport-001-783-756 [1,0,0,0,0,0|3,0,0]=4 31 B6R0.6 CCCCCCN Molport-001-768-945 [1,0,0,0,0,0|3,0,0]=4 32 B6R0.6 CCCCNCC Molport-001-791-759 [1,0,0,0,0,0|3,0,0]=4 33 B6R0.6 CCOCCCN Molport-001-791-503 [1,0,0,0,0,0|3,0,0]=4 34 B6R0.6 CCOCCNC Molport-011-940-592 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.6 CCOCOCC Molport-003-934-226 [1,0,0,0,0,0|3,0,0]=4 36 B6R0.6 COCCN=C=O Molport-002-039-853 [1,0,0,0,0,0|3,0,0]=4 37 B6R0.6 NCCCNC=O Molport-003-761-655 [1,0,0,0,0,0|3,0,0]=4 38 B8R0.5 C/C(=C/C=O)/CC(C)C Molport-002-507-365 [0,1,0,0,0,0|2,0,1]=4 39 B8R0.7 CC(=O)CCCOC=O Molport-002-704-977 [0,1,0,0,0,0|2,0,1]=4 40 B8R0.7 CC(C)CNCCCO Molport-002-000-550 [0,1,0,0,0,0|2,0,1]=4 41 B8R0.8 C=CCCC(N)C(C)C Molport-044-184-649 [0,1,0,0,0,0|3,0,0]=4 42 B8R0.28 CC(=O)OCCC(C)C Molport-000-872-035 [0,1,0,0,0,0|1,0,0]=2 43 B8R0.28 CC(C)CCOC(=S)[S-] Molport-008-356-154 [0,1,0,0,0,0|1,1,0]=3 44 B8R0.28 CC(C)CNCC(=O)O Molport-005-231-062 [0,1,0,0,0,0|3,0,0]=4 45 B8R0.28 CC(C)COCC(=O)N Molport-002-786-905 [0,1,0,0,0,0|3,0,0]=4 46 B8R0.28 CC(C)NCCC(=O)N Molport-006-702-885 [0,1,0,0,0,0|3,0,0]=4 47 B8R0.28 CN(C)CCCC(=O)O Molport-001-792-192 [0,1,0,0,0,0|3,0,0]=4 48 B8R0.28 CN(C)CCCC(=O)O Molport-003-928-817 [0,1,0,0,0,0|3,0,0]=4 49 B8R1.4 CC1CCCC(=O)C1 Molport-001-793-304 [0,0,0,1,0,0|2,0,0]=3 50 B8R1.4 CC1CCCC(C1)O Molport-001-791-996 [0,0,0,1,0,0|2,0,1]=4 51 B8R1.4 CC1CCN=C(C1)N Molport-035-681-776 [0,0,0,1,0,0|3,0,0]=4 52 B8R1.4 CC1CCNC(C1)C Molport-000-887-472 [0,0,0,1,0,0|3,0,0]=4 53 B8R1.4 CC1CCOB(O1)O Molport-030-082-325 [0,0,0,1,0,0|2,0,1]=4 54 B8R1.7 CC(C)C1CCCN1 Molport-000-147-589 [0,0,0,1,0,0|3,0,0]=4 55 B8R1.7 CC(C)C1CCNC1 Molport-013-757-987 [0,0,0,1,0,0|2,0,1]=4 56 B8R1.19 CC1(CCCC1N)C Molport-044-755-182 [0,0,0,1,0,0|3,0,0]=4 57 B8R1.19 CC1(CCCC1O)C Molport-006-758-082 [0,0,0,1,0,0|2,0,1]=4 58 B8R1.19 CC1(CCNC1=O)C Molport-009-195-986 [0,0,0,1,0,0|2,0,0]=3 59 B8R1.19 CC1(CCNC1=O)N Molport-022-364-766 [0,0,0,1,0,0|3,0,0]=4 60 B8R1.19 CC1(CCOC1=O)C Molport-009-198-442 [0,0,0,1,0,0|1,0,0]=2 61 B8R1.19 CC1(CONC1=O)C Molport-020-313-574 [0,0,0,1,0,0|3,0,0]=4 62 B8R1.19 CC1(NCCC1=O)C Molport-027-837-709 [0,0,0,1,0,0|3,0,0]=4 63 B8R1.19 CC1NCCC1(C)C Molport-013-611-317 [0,0,0,1,0,0|3,0,0]=4 64 B8R1.22 CC1CCCNCC1 Molport-008-154-407 [0,0,0,1,0,0|2,0,1]=4 65 B8R1.22 CC1CCCNCC1 Molport-028-913-173 [0,0,0,1,0,0|2,0,1]=4 66 B8R1.72 CC1(CCCNC1)C Molport-000-124-671 [0,0,0,1,0,0|2,0,1]=4 67 B5R0.1 C=C(C)CCO Molport-003-926-226 [2,0,0,0,0,0|0,0,2]=4 68 B5R0.1 CC(C)/C=N/O Molport-000-139-603 [2,0,0,0,0,0|0,0,2]=4 69 B5R0.1 CC(C)C=NO Molport-003-909-959 [2,0,0,0,0,0|0,0,2]=4 70 B5R0.1 CC(C)CC=O Molport-001-787-528 [2,0,0,0,0,0|0,0,1]=3 71 B5R0.1 CC(C)CCBr Molport-000-875-341 [2,0,0,0,0,0|1,0,0]=3 72 B5R0.1 CC(C)CCCl Molport-001-783-738 [2,0,0,0,0,0|1,0,0]=3 73 B5R0.1 CC(C)CCI Molport-001-770-162 [2,0,0,0,0,0|1,0,0]=3 74 B5R0.1 CC(C)CCN Molport-003-927-223 [2,0,0,0,0,0|0,0,1]=3 75 B5R0.1 CC(C)CCO Molport-001-793-103 [2,0,0,0,0,0|0,0,0]=2 76 B5R0.1 CC(C)N=C=O Molport-001-732-437 [2,0,0,0,0,0|1,0,1]=4 77 B5R0.1 CC(O)CCO Molport-003-927-418 [2,0,0,0,0,0|1,0,0]=3 78 B5R0.1 CCC[C@H](C)N Molport-039-014-155 [2,0,0,0,0,0|2,0,0]=4 79 B5R0.1 CN(C)CCN Molport-001-769-719 [2,0,0,0,0,0|1,0,1]=4 80 B5R0.1 COCC(C)O Molport-001-793-107 [2,0,0,0,0,0|2,0,0]=4 81 B5R0.2 CCCCC=O Molport-001-768-920 [2,0,0,0,0,0|1,0,0]=3 82 B5R0.2 CCCCCBr Molport-001-768-933 [2,0,0,0,0,0|2,0,0]=4 83 B5R0.2 CCCCCC Molport-016-899-216 [2,0,0,0,0,0|2,0,0]=4 84 B5R0.2 CCCCCI Molport-001-783-755 [2,0,0,0,0,0|2,0,0]=4 85 B5R0.2 CCCCCN Molport-001-759-278 [2,0,0,0,0,0|1,0,1]=4 86 B5R0.2 CCCCNC Molport-001-787-403 [2,0,0,0,0,0|1,0,1]=4 87 B5R0.2 CCCN=C=O Molport-001-732-519 [2,0,0,0,0,0|2,0,0]=4 88 B5R0.2 CNCCOC Molport-003-993-522 [2,0,0,0,0,0|2,0,0]=4 89 B5R0.2 COCCCN Molport-001-794-234 [2,0,0,0,0,0|2,0,0]=4 90 B5R0.2 COCCCO Molport-001-756-376 [2,0,0,0,0,0|2,0,0]=4 91 B5R0.2 COCCOC Molport-003-928-695 [2,0,0,0,0,0|2,0,0]=4 92 B5R0.2 COCCON Molport-008-604-171 [2,0,0,0,0,0|1,0,1]=4 93 B7R0.2 C#C[C@@H](N)CC(C)C Molport-051-695-351 [1,1,0,0,0,0|2,0,0]=4 94 B7R0.2 CC(C)C/C(=N/O)/N Molport-005-933-122 [1,1,0,0,0,0|0,0,2]=4 95 B7R0.3 C=CCCC(C)CN Molport-021-452-967 [1,1,0,0,0,0|2,0,0]=4 96 B7R0.3 C=CCCC(C)CN Molport-046-425-328 [1,1,0,0,0,0|2,0,0]=4 97 B7R0.3 COCCC(N)CO Molport-020-915-935 [1,1,0,0,0,0|2,0,0]=4 98 B7R0.5 CC(C)C(O)CCN Molport-008-643-583 [1,1,0,0,0,0|1,0,1]=4 99 B7R0.6 CC(=O)CCN(C)C Molport-002-485-442 [1,1,0,0,0,0|2,0,0]=4 100 B7R0.6 CC(=O)CSC(C)C Molport-004-770-656 [1,1,0,0,0,0|2,0,0]=4 101 B7R0.6 CC(C)CNC(=O)N Molport-001-817-450 [1,1,0,0,0,0|2,0,0]=4 102 B7R0.6 CC(C)COC(=O)Cl Molport-001-767-556 [1,1,0,0,0,0|1,0,0]=3 103 B7R0.6 CC(C)NCC(=O)O Molport-002-472-582 [1,1,0,0,0,0|2,0,0]=4 104 B7R0.6 CC(C)OCC(=O)O Molport-002-683-574 [1,1,0,0,0,0|2,0,0]=4 105 B7R0.6 CC(C)SCC(=O)O Molport-000-679-256 [1,1,0,0,0,0|2,0,0]=4 106 B7R0.6 CN(C)CCC(=O)O Molport-001-790-337 [1,1,0,0,0,0|2,0,0]=4 107 B7R0.8 CC(C)(C)CCCN Molport-014-088-020 [1,1,0,0,0,0|1,0,1]=4 108 B7R0.8 CC(C)(C)CN=C=O Molport-004-342-224 [1,1,0,0,0,0|2,0,0]=4 109 B7R0.8 CCOCC(C)(C)N Molport-029-997-583 [1,1,0,0,0,0|2,0,0]=4 110 B7R0.8 CNCCC(C)(C)O Molport-016-631-094 [1,1,0,0,0,0|1,0,1]=4 111 B7R0.1 CCCCOCCO Molport-001-791-489 [1,1,0,0,0,0|1,0,1]=4 112 B7R0.1 COCCCN=C=O Molport-003-748-783 [1,1,0,0,0,0|2,0,0]=4 113 B9R0.53 CC(C)CC(O)CC(=O)O Molport-008-643-782 [0,2,0,0,0,0|2,0,0]=4 114 B9R0.1 CC(C)CCNC(=O)CCl Molport-004-354-209 [0,2,0,0,0,0|2,0,0]=4 115 B9R0.1 CC(C)CCOC(=O)CCl Molport-003-910-676 [0,2,0,0,0,0|1,0,0]=3 116 B9R0.7 CC(C)CCC(F)C(=O)O Molport-029-703-342 [0,2,0,0,0,0|2,0,0]=4 117 B9R0.56 CC(C)CCNS(=O)(=O)C Molport-002-930-453 [0,2,0,0,0,0|2,0,0]=4 118 B7R1.2 CC1COC(=O)O1 Molport-003-929-830 [1,0,0,1,0,0|2,0,0]=4 119 B7R1.2 C[C@@H]1CNC(=O)C1 Molport-027-948-657 [1,0,0,1,0,0|2,0,0]=4 120 B7R1.2 C[C@@H]1COC(=O)O1 Molport-001-758-105 [1,0,0,1,0,0|2,0,0]=4 121 B7R1.2 O=C1C[C@@H](CO1)O Molport-001-793-714 [1,0,0,1,0,0|2,0,0]=4 122 B7R1.3 CC1CCCNC1 Molport-001-768-820 [1,0,0,1,0,0|1,0,1]=4 123 B7R1.3 CC1CCNCC1 Molport-000-157-467 [1,0,0,1,0,0|1,0,1]=4 124 B7R1.3 CC1CCNCC1 Molport-000-677-243 [1,0,0,1,0,0|1,0,1]=4 125 B7R1.3 CC1CCNCC1 Molport-028-912-924 [1,0,0,1,0,0|1,0,1]=4 126 B7R1.3 CN1CCOCC1 Molport-000-882-332 [1,0,0,1,0,0|2,0,0]=4 127 B7R1.3 NC1CCOCC1 Molport-000-001-134 [1,0,0,1,0,0|2,0,0]=4 128 B7R1.3 NC1CCOCC1 Molport-001-757-424 [1,0,0,1,0,0|2,0,0]=4 129 B7R1.3 OC1CCOCC1 Molport-000-142-861 [1,0,0,1,0,0|2,0,0]=4 130 B7R1.5 CC1CC1N=C=O Molport-004-352-087 [1,0,0,1,0,0|2,0,0]=4 131 B7R1.7 O=C=NCC1CC1 Molport-013-117-774 [1,0,0,1,0,0|2,0,0]=4 132 B7R1.14 CC1(CCCN1)C Molport-001-781-707 [1,0,0,1,0,0|1,0,1]=4 133 B7R1.14 CC1(CCNC1)C Molport-006-703-025 [1,0,0,1,0,0|1,0,1]=4 134 B7R1.1 O=CN1CCCC1 Molport-002-501-742 [1,0,0,1,0,0|2,0,0]=4 135 B7R1.4 NC1CCOC1=O Molport-001-787-398 [1,0,0,1,0,0|2,0,0]=4 136 B7R1.4 NC1CCOC1=O Molport-019-989-908 [1,0,0,1,0,0|2,0,0]=4 137 B7R1.4 O=C1OCCC1Br Molport-001-768-893 [1,0,0,1,0,0|2,0,0]=4 138 B7R1.6 O=C=NC1CCC1 Molport-004-338-929 [1,0,0,1,0,0|2,0,0]=4 139 B9R1.34 CC1CC(=O)OC(=O)C1 Molport-001-768-069 [0,1,0,1,0,0|1,0,1]=4 140 B9R1.48 CC1CC(=O)NCCS1 Molport-027-844-557 [0,1,0,1,0,0|2,0,0]=4 141 B9R1.1 CN1CCN(CC1)N=O Molport-006-121-772 [0,1,0,1,0,0|2,0,0]=4 142 B9R1.118 CC1(CCOCC1)CN Molport-011-110-286 [0,1,0,1,0,0|2,0,0]=4 143 B9R1.118 CC1(CCOCC1)CO Molport-026-526-324 [0,1,0,1,0,0|2,0,0]=4 144 B9R1.40 CC1(NCCOC1=O)C Molport-003-786-067 [0,1,0,1,0,0|1,0,0]=3 145 B9R1.35 CC(C)C1CNC(=O)C1 Molport-016-636-049 [0,1,0,1,0,0|2,0,0]=4 146 B9R1.138 CC1(CCC(C1=O)Br)C Molport-026-972-098 [0,1,0,1,0,0|2,0,0]=4 147 B9R2.5 O=C1CCCC12CC2 Molport-022-909-244 [0,0,0,2,0,0|2,0,0]=4