0 B15R2.1428 CCCCC1OC(=O)C2=C1CCC=C2 Molport-039-052-280 [0,0,0,0,0,0|0,0,4]=4 1 B15R2.1428 CCCC[C@@H]1OC(=O)C2=C1CCC=C2 Molport-027-720-911 [0,0,0,0,0,0|0,0,4]=4 2 B15R2.1428 CO/N=C/C1SC(=O)C2=C1C=CC=C2 Molport-002-882-616 [0,0,0,0,0,0|2,1,1]=4 3 B14R2.510 CCCN1N=C(C2=CC=CC=C12)N Molport-013-400-145 [1,0,0,0,0,0|3,0,0]=4 4 B14R2.510 CCOC1OC(=O)C2=NC=CC=C12 Molport-023-335-555 [1,0,0,0,0,0|2,0,1]=4 5 B16R2.31634 CCCCN1C=C(C2=CC=CC=C12)C=O Molport-000-164-474 [0,1,0,0,0,0|2,0,1]=4 6 B14R1.38 CCCCCOC(=O)C1=CC=CC=C1 Molport-001-786-490 [0,0,1,0,0,0|0,0,2]=3 7 B14R1.38 O=C(OCCCCO)C1=CC=CC=C1 Molport-048-608-414 [0,0,1,0,0,0|1,0,2]=4 8 B14R1.903 CCCCNC1=C(C=CC=C1)C(=O)O Molport-000-632-023 [0,0,1,0,0,0|1,0,1]=3 9 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)N Molport-002-306-740 [0,0,1,0,0,0|2,0,1]=4 10 B14R1.903 CCCCSC1=C(C=CC=C1)C(=O)O Molport-002-788-894 [0,0,1,0,0,0|1,0,1]=3 11 B14R1.903 COCCSC1=C(C=CC=C1)C(=O)O Molport-002-789-359 [0,0,1,0,0,0|2,0,1]=4 12 B16R3.20606 O=C1C2=CC=CC=C2C3=NCCCN13 Molport-001-814-823 [0,0,0,1,0,0|2,0,0]=3 13 B16R3.20606 O=C1C2=CC=CC=C2C3N1CCCN3 Molport-000-144-151 [0,0,0,1,0,0|2,0,1]=4 14 B16R3.20606 O=C1C2=CC=CC=C2C3N1CCCO3 Molport-019-738-540 [0,0,0,1,0,0|2,0,1]=4 15 B16R2.1054 CCCSC1=NC2=CC=CC=C2C(=N1)O Molport-046-793-920 [0,0,0,0,0,1|2,0,1]=4 16 B16R2.12192 CCCNC1=C2C=CC=CC2=C(N=N1)Cl Molport-013-838-411 [0,0,0,0,0,1|3,0,0]=4 17 B16R2.12202 CCCNC1=NC(=NC2=CC=CC=C12)Cl Molport-003-790-234 [0,0,0,0,0,1|3,0,0]=4 18 B16R2.12202 CCCOC1=CC(=O)NC2=CC=CC=C12 Molport-035-926-895 [0,0,0,0,0,1|2,0,0]=3 19 B13R1.84 CCCCOC1=C(C=CC=C1)C=O Molport-000-885-977 [1,0,1,0,0,0|1,0,1]=4 20 B13R1.572 CCCOC1=C(C=CC=C1)C(=O)O Molport-000-900-748 [1,0,1,0,0,0|1,0,0]=3 21 B13R1.572 CCCOC1=CC=CC=C1C(=O)N Molport-003-850-005 [1,0,1,0,0,0|2,0,0]=4 22 B13R1.572 CCCSC1=C(C=CC=C1)C(=O)O Molport-002-788-008 [1,0,1,0,0,0|1,0,0]=3 23 B13R1.572 CCCSC1=C(C=CC=N1)C(=O)O Molport-000-141-705 [1,0,1,0,0,0|2,0,0]=4 24 B13R1.572 CCNCC1=C(C=CC=C1)C(=O)O Molport-000-866-838 [1,0,1,0,0,0|1,0,1]=4 25 B13R1.572 NCCSC1=C(C=CC=C1)C(=O)O Molport-019-992-161 [1,0,1,0,0,0|2,0,0]=4 26 B13R1.572 O=C(O)C1=CC=CC=C1OCCF Molport-023-612-505 [1,0,1,0,0,0|2,0,0]=4 27 B13R2.1 CCCN1C=CC2=CC=CC=C12 Molport-003-844-198 [2,0,0,0,0,0|2,0,0]=4 28 B13R2.2931 C/C=C/1\OC(=O)C2=C1C=CC=C2 Molport-000-699-095 [2,0,0,0,0,0|0,0,0]=2 29 B13R2.2931 CC[N+]1=C2C=CC=CC2=C(O1)C Molport-047-118-556 [2,0,0,0,0,0|2,0,0]=4 30 B15R1.30 CCC/C=N/NC(=O)C1=CC=C(C=C1)Br Molport-000-431-396 [0,1,1,0,0,0|2,0,0]=4 31 B15R1.30 CCC/C=N/NC(=O)C1=CC=C(C=C1)F Molport-007-553-552 [0,1,1,0,0,0|2,0,0]=4 32 B15R1.30 CCCCCOC(=O)C1=CC=C(C=C1)N Molport-002-046-946 [0,1,1,0,0,0|0,0,2]=4 33 B15R1.30 CCCCCOC(=O)C1=CC=C(C=C1)O Molport-003-719-476 [0,1,1,0,0,0|0,0,2]=4 34 B15R1.31 CCC/C=N/NC(=O)C1=CC(=CC=C1)Br Molport-007-553-549 [0,1,1,0,0,0|2,0,0]=4 35 B15R1.31 CCC/C=N/NC(=O)C1=CC(=CC=C1)F Molport-019-088-620 [0,1,1,0,0,0|2,0,0]=4 36 B15R1.31 CCC/C=N/NC(=O)C1=CC(=CC=C1)O Molport-000-431-326 [0,1,1,0,0,0|2,0,0]=4 37 B15R1.31 CCCCCOC(=O)C1=CC(=CC=C1)F Molport-003-721-160 [0,1,1,0,0,0|0,0,2]=4 38 B15R1.115 CCCNC(=S)NC(=O)C1=CC=CC=C1 Molport-002-132-233 [0,1,1,0,0,0|2,0,0]=4 39 B15R1.138 CC/C=C\CCOC(=O)C1=CC=CC=C1 Molport-003-960-155 [0,1,1,0,0,0|0,0,2]=4 40 B15R1.138 CCCC/C=N/NC(=O)C1=CC=CC=C1 Molport-002-319-613 [0,1,1,0,0,0|1,0,1]=4 41 B15R1.138 CCCCCCOC(=O)C1=CC=CC=C1 Molport-001-786-489 [0,1,1,0,0,0|0,0,2]=4 42 B15R1.3965 CCC/C=N/NC(=O)C1=C(C=CC=C1)C Molport-000-447-469 [0,1,1,0,0,0|2,0,0]=4 43 B15R1.3965 CCC/C=N/NC(=O)C1=C(C=CC=C1)Cl Molport-000-431-341 [0,1,1,0,0,0|2,0,0]=4 44 B15R1.241 CCCCCNC1=C(C=CC=C1)C(=O)O Molport-000-877-064 [0,1,1,0,0,0|0,0,2]=4 45 B15R1.241 CCCCCOC1=C(C=CC=C1)C(=O)O Molport-000-900-747 [0,1,1,0,0,0|0,0,2]=4 46 B15R1.559 CCCCNC1=C(C=C(C=C1)Br)C(=O)O Molport-000-880-735 [0,1,1,0,0,0|1,0,1]=4 47 B15R1.559 CCCCOC1=C(C=C(C=C1)Br)C(=O)O Molport-000-900-770 [0,1,1,0,0,0|1,0,1]=4 48 B15R1.559 CCCCOC1=C(C=C(C=C1)Cl)C(=O)O Molport-003-773-909 [0,1,1,0,0,0|1,0,1]=4 49 B15R1.1239 O=C(O)C1=C(C=CC=C1)C(=O)NCCO Molport-000-389-112 [0,1,1,0,0,0|2,0,0]=4 50 B15R1.1239 O=C(O)C1=C(C=CC=C1)C(=O)OCCO Molport-001-965-683 [0,1,1,0,0,0|2,0,0]=4 51 B15R1.1274 CCCC(=O)NC1=C(C=CC=C1)C(=O)O Molport-001-549-473 [0,1,1,0,0,0|1,0,0]=3 52 B15R1.8882 CC(C)CCSC1=C(C=CC=C1)C(=O)O Molport-002-788-122 [0,1,1,0,0,0|1,0,1]=4 53 B15R2.73 CCCC(=O)C1=CNC2=CC=CC=C12 Molport-001-788-756 [1,1,0,0,0,0|2,0,0]=4 54 B15R2.11492 CCCN1C=C(C2=CC=CC=C12)C=O Molport-001-001-226 [1,1,0,0,0,0|2,0,0]=4 55 B15R2.23388 CC/C(=C/1\OC(=O)C2=C1CCC=C2)/C Molport-051-579-413 [1,1,0,0,0,0|0,0,2]=4 56 B15R2.53147 CN(C)/C=C/1\OC(=O)C2=C1C=CC=C2 Molport-002-852-968 [1,1,0,0,0,0|1,0,0]=3 57 B15R2.53147 CN(C)/C=C/1\SC(=O)C2=C1C=CC=C2 Molport-001-844-876 [1,1,0,0,0,0|1,1,0]=4 58 B15R2.53147 NC(=O)/C=C/1\OC(=O)C2=C1C=CC=C2 Molport-002-552-237 [1,1,0,0,0,0|1,0,1]=4 59 B15R2.53147 O=C(O)/C=C\1/OC(=O)C2=C1C=CC=C2 Molport-000-875-406 [1,1,0,0,0,0|1,0,1]=4 60 B17R2.40403 CC(C)COC1=NC2=CC=CC=C2C(=O)O1 Molport-009-757-703 [0,1,0,0,0,1|1,0,0]=3 61 B17R2.49938 CCNC(=O)C1=NC2=CC=CC=C2C(=O)N1 Molport-008-388-391 [0,1,0,0,0,1|2,0,0]=4 62 B17R2.49938 CCOC(=O)C1=CC(=O)C2=CC=CC=C2N1 Molport-009-705-065 [0,1,0,0,0,1|2,0,0]=4 63 B17R2.49938 CCOC(=O)C1=CC2=CC=CC=C2C(=O)S1 Molport-000-251-090 [0,1,0,0,0,1|1,1,0]=4 64 B17R2.49938 CCOC(=O)C1CC2=C(C=CC=C2)C(=O)O1 Molport-000-455-284 [0,1,0,0,0,1|1,0,1]=4 65 B17R2.56354 CCCCC1=NC2=CC=CC=C2C(=O)N1N Molport-002-287-948 [0,1,0,0,0,1|1,0,1]=4 66 B17R2.56354 CCCSC1=NC2=CC=CC=C2C(=O)N1C Molport-001-944-342 [0,1,0,0,0,1|2,0,0]=4 67 B17R2.56354 CCCSC1=NC2=CC=CC=C2C(=O)N1N Molport-047-805-987 [0,1,0,0,0,1|2,0,0]=4 68 B17R2.50010 CCNC(=O)C1=NNC(=O)C2=CC=CC=C12 Molport-002-726-324 [0,1,0,0,0,1|2,0,0]=4 69 B17R2.50010 CCOC(=O)C1=NNC(=O)C2=CC=CC=C12 Molport-002-728-199 [0,1,0,0,0,1|2,0,0]=4 70 B17R2.345886 CCCOC1=CC=C(C2=CC=CC=C12)C=O Molport-018-651-402 [0,1,0,0,0,1|2,0,0]=4 71 B17R2.5014 CC(O)CNC1=CC(=O)OC2=CC=CC=C12 Molport-002-021-121 [0,1,0,0,0,1|2,0,0]=4 72 B17R2.12128 CCCCNC1=CC(=O)OC2=CC=CC=C12 Molport-000-163-467 [0,1,0,0,0,1|1,0,1]=4 73 B17R2.12128 O=C1C=C(C2=CC=CC=C2O1)NCCCO Molport-001-682-691 [0,1,0,0,0,1|2,0,0]=4 74 B17R2.50020 CCCC(=O)N1CC(=O)NC2=C1C=CC=C2 Molport-005-303-427 [0,1,0,0,0,1|2,0,0]=4 75 B17R2.138659 CCCNC1=C(C(=O)OC2=CC=CC=C12)N Molport-047-117-942 [0,1,0,0,0,1|2,0,0]=4 76 B17R2.1022756 CCCC(=O)N1C(=O)C(=O)C2=C1C=CC=C2 Molport-002-322-431 [0,2,0,0,0,0|2,0,0]=4 77 B15R2.886 CCCC1=NC2=CC=CC=C2C(=O)N1 Molport-002-006-548 [0,0,1,1,0,0|2,0,0]=4 78 B15R2.1221 O=C(O)C1=C(C=CC=C1)C2CCCC2 Molport-021-876-049 [0,0,1,1,0,0|0,0,2]=4 79 B15R2.1221 O=C(O)C1=C(C=CC=C1)N2CCCC2 Molport-004-411-564 [0,0,1,1,0,0|1,0,1]=4 80 B15R2.1221 O=C(O)C1=C(C=CC=C1)N2CCCC2 Molport-039-330-869 [0,0,1,1,0,0|1,0,1]=4 81 B15R2.13611 CC1=C2C=CC=C(C2=CC=C1)C(=O)O Molport-022-375-806 [0,0,1,1,0,0|0,0,2]=4 82 B15R2.9978 CCCN1C(=O)C2=CC=CC=C2C1=O Molport-001-593-205 [0,0,1,1,0,0|1,0,1]=4 83 B15R2.9978 CCCN1C(=O)C2=CC=CC=C2C1O Molport-002-934-946 [0,0,1,1,0,0|1,0,1]=4 84 B15R2.19973 CCN1N=C(C2=CC=CC=C2C1=O)O Molport-018-558-257 [0,0,1,1,0,0|2,0,0]=4 85 B17R3.35227 O=C1C2=CC=CC=C2N=C3N1CCCN3 Molport-001-624-649 [0,0,0,1,0,1|2,0,0]=4 86 B17R3.35227 O=C1C2=CC=CC=C2N=C3N1CCCS3 Molport-001-493-008 [0,0,0,1,0,1|2,0,0]=4 87 B17R3.7829 O=C1OC(C2=CC=CC=C12)N3CCCC3 Molport-001-558-370 [0,1,0,1,0,0|0,0,2]=4 88 B17R3.1109591 O=C1OC2(CCNCC2)C3=C1C=CC=C3 Molport-003-985-319 [0,1,0,1,0,0|0,0,2]=4 89 B15R1.83 CCC/C=N/NC(=O)CC1=CC=CC=C1 Molport-002-944-794 [0,0,1,0,0,1|2,0,0]=4 90 B15R1.1188 CCCCOC1=C(C=CC=C1)CC(=O)O Molport-000-148-543 [0,0,1,0,0,1|1,0,1]=4 91 B15R2.4392 CCOC1=CC(=O)NC2=CC=CC=C12 Molport-035-926-902 [1,0,0,0,0,1|2,0,0]=4 92 B15R2.4392 CNCC1=CC(=O)NC2=CC=CC=C12 Molport-000-777-844 [1,0,0,0,0,1|2,0,0]=4