0 B9R1.35 CC1=CC(SC1)C(=O)O Molport-016-583-556 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.35 CC1=NOC(C1)C(=O)O Molport-002-678-930 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.35 CN1C=NC(C1)C(=O)O Molport-023-314-200 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.35 CN1CCC(C1)C(=O)O Molport-001-794-865 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O Molport-023-219-522 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.35 NC1CNC(C1)C(=O)O Molport-028-600-683 [0,0,0,0,0,0|1,0,0]=1 6 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O Molport-003-793-979 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.35 O=C(O)C1=CC(=NN1)O Molport-019-938-315 [0,0,0,0,0,0|1,0,3]=4 8 B9R1.35 O=C(O)C1=NC(=NN1)O Molport-019-908-660 [0,0,0,0,0,0|2,0,2]=4 9 B9R1.35 O=C1CC(CN1)C(=O)O Molport-000-005-185 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.35 O=C1CC(NN1)C(=O)O Molport-022-365-593 [0,0,0,0,0,0|1,0,2]=3 11 B9R1.35 O=C1C[C@@H](CN1)C(=O)O Molport-035-868-754 [0,0,0,0,0,0|2,0,2]=4 12 B8R1.1 OCC1CC(CN1)O Molport-027-713-914 [1,0,0,0,0,0|0,0,1]=2 13 B8R1.7 CC(=O)C1CCNC1 Molport-028-600-513 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.7 CC(C)C1CCCN1 Molport-000-147-589 [1,0,0,0,0,0|2,0,1]=4 15 B8R1.7 FC(F)C1CCCN1 Molport-029-079-098 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.7 FC(F)[C@@H]1CCCN1 Molport-027-713-869 [1,0,0,0,0,0|2,0,1]=4 17 B8R1.7 N=C(N)C1CCCC1 Molport-004-331-540 [1,0,0,0,0,0|3,0,0]=4 18 B8R1.7 NC(=O)C1=NCCN1 Molport-000-003-238 [1,0,0,0,0,0|2,0,1]=4 19 B8R1.7 NC(=O)C1CCCC1 Molport-016-633-567 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.7 NC(=O)C1CCCN1 Molport-002-465-320 [1,0,0,0,0,0|1,0,0]=2 21 B8R1.7 NC(=O)C1CCCN1 Molport-004-946-899 [1,0,0,0,0,0|1,0,0]=2 22 B8R1.7 NC(=O)C1CCCO1 Molport-008-550-649 [1,0,0,0,0,0|2,0,0]=3 23 B8R1.7 NC(=O)C1CCOC1 Molport-009-013-886 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.7 O=C(Cl)C1CCCC1 Molport-001-794-196 [1,0,0,0,0,0|2,0,0]=3 25 B8R1.7 O=C(Cl)C1CCOC1 Molport-009-013-740 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.7 O=C(Cl)N1CCCC1 Molport-001-793-403 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.7 O=C(O)C1C=CCN1 Molport-001-769-493 [1,0,0,0,0,0|0,0,2]=3 28 B8R1.7 O=C(O)C1CC=CC1 Molport-000-002-501 [1,0,0,0,0,0|1,0,2]=4 29 B8R1.7 O=C(O)C1CCCN1 Molport-027-837-861 [1,0,0,0,0,0|0,0,0]=1 30 B8R1.7 O=C(O)C1CCCS1 Molport-021-746-238 [1,0,0,0,0,0|1,0,0]=2 31 B8R1.7 O=C(O)C1CCNC1 Molport-002-499-434 [1,0,0,0,0,0|2,0,0]=3 32 B8R1.7 O=C(O)C1SCCS1 Molport-004-768-996 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.7 O=C([O-])C1CSCN1 Molport-006-107-116 [1,0,0,0,0,0|1,0,1]=3 34 B8R1.7 O=[N+]([O-])C1CCCC1 Molport-001-790-449 [1,0,0,0,0,0|2,0,1]=4 35 B10R1.14 COC(=O)C1CC(CN1)O Molport-004-414-815 [0,1,0,0,0,0|0,0,0]=1 36 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F Molport-020-003-954 [0,1,0,0,0,0|1,0,0]=2 37 B10R1.58 CN1C[C@H](NC1=O)C(=O)O Molport-038-941-438 [0,1,0,0,0,0|2,0,1]=4 38 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O Molport-046-472-523 [0,1,0,0,0,0|1,0,0]=2 39 B10R1.58 O=C(O)C1CC([C@@H](C1)Br)Br Molport-000-651-334 [0,1,0,0,0,0|2,0,0]=3 40 B10R1.59 CN1NC(=O)CC1C(=O)O Molport-047-633-212 [0,1,0,0,0,0|1,0,2]=4 41 B10R1.359 O=C(O)C1CC(CN1)(F)F Molport-020-168-493 [0,1,0,0,0,0|1,0,0]=2 42 B8R0.8 C=CCCC(C)C(=O)O Molport-022-365-513 [0,0,1,0,0,0|2,0,1]=4 43 B8R0.8 CC(CCCCl)C(=O)O Molport-004-946-900 [0,0,1,0,0,0|2,0,0]=3 44 B8R0.8 CC(OCCN)C(=O)O Molport-028-956-914 [0,0,1,0,0,0|2,0,0]=3 45 B8R0.8 CCCCC(Br)C(=O)O Molport-001-779-710 [0,0,1,0,0,0|3,0,0]=4 46 B8R0.8 CCCCC(C)C(=O)N Molport-002-131-902 [0,0,1,0,0,0|3,0,0]=4 47 B8R0.8 CCCCC(F)C(=O)O Molport-037-963-463 [0,0,1,0,0,0|3,0,0]=4 48 B8R0.8 CCCC[C@H](C)C(=O)O Molport-030-086-570 [0,0,1,0,0,0|2,0,0]=3 49 B8R0.8 CCCNC(=O)C(=O)O Molport-006-068-721 [0,0,1,0,0,0|2,0,1]=4 50 B8R0.8 CCCOC(C)C(=O)O Molport-009-200-570 [0,0,1,0,0,0|2,0,0]=3 51 B8R0.8 CCOCC(C)C(=O)O Molport-009-675-620 [0,0,1,0,0,0|3,0,0]=4 52 B8R0.8 NCCCC(N)C(=O)O Molport-003-958-892 [0,0,1,0,0,0|3,0,0]=4 53 B8R0.9 C#CC(N)CCC(=O)O Molport-046-071-597 [0,0,1,0,0,0|2,0,1]=4 54 B8R0.9 C=CC(N)CCC(=O)O Molport-039-240-479 [0,0,1,0,0,0|2,0,1]=4 55 B8R0.9 CCS(=O)CCC(=O)O Molport-006-066-897 [0,0,1,0,0,0|2,0,1]=4 56 B8R0.15 CCCC(CC)C(=O)O Molport-006-123-148 [0,0,1,0,0,0|2,0,0]=3 57 B8R0.15 CCCC(NC)C(=O)O Molport-012-161-172 [0,0,1,0,0,0|1,0,0]=2 58 B8R0.23 CC(=O)CC(N)C(=O)O Molport-023-314-128 [0,0,1,0,0,0|0,0,2]=3 59 B8R0.23 CC(C)CC(F)C(=O)O Molport-019-991-178 [0,0,1,0,0,0|2,0,0]=3 60 B8R0.23 CC(C)CC(N)C(=O)N Molport-001-816-617 [0,0,1,0,0,0|2,0,0]=3 61 B8R0.23 CC(C)C[C@H]([15NH2])[13C](=O)O Molport-003-934-624 [0,0,1,0,0,0|1,0,0]=2 62 B8R0.23 CC(CC(F)F)C(=O)O Molport-015-163-790 [0,0,1,0,0,0|3,0,0]=4 63 B8R0.23 CC(CN(C)C)C(=O)O Molport-005-958-941 [0,0,1,0,0,0|3,0,0]=4 64 B8R0.23 CC(CN(C)C)C(=O)O Molport-006-066-798 [0,0,1,0,0,0|3,0,0]=4 65 B8R0.23 NC(CC(F)F)C(=O)O Molport-016-635-649 [0,0,1,0,0,0|2,0,0]=3 66 B8R0.23 NC(CS(=O)O)C(=O)O Molport-002-512-295 [0,0,1,0,0,0|2,0,0]=3 67 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Molport-035-865-273 [0,0,1,0,0,0|1,0,2]=4 68 B8R0.23 O=C(O)CC(S)C(=O)O Molport-001-763-895 [0,0,1,0,0,0|2,0,1]=4 69 B8R0.23 O=C(O)CC(S)C(=O)O Molport-051-552-437 [0,0,1,0,0,0|2,0,1]=4 70 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(=O)O Molport-003-934-579 [0,0,1,0,0,0|1,0,2]=4 71 B8R0.28 CC(C)CNCC(=O)O Molport-005-231-062 [0,0,1,0,0,0|1,0,0]=2 72 B8R0.28 CC(C)CNCC(C)O Molport-002-499-012 [0,0,1,0,0,0|2,0,1]=4 73 B8R0.28 CC(C)COCC(=O)N Molport-002-786-905 [0,0,1,0,0,0|3,0,0]=4 74 B8R0.28 CC(O)CNCC(C)O Molport-001-789-470 [0,0,1,0,0,0|1,0,1]=3 75 B8R0.28 CN(C)CCCC(=O)O Molport-001-792-192 [0,0,1,0,0,0|3,0,0]=4 76 B8R0.28 CN(C)CCCC(=O)O Molport-003-928-817 [0,0,1,0,0,0|3,0,0]=4 77 B8R0.28 O=C(O)COCC(=O)O Molport-003-926-440 [0,0,1,0,0,0|2,0,1]=4 78 B8R0.28 O=C(O)CSCC(=O)O Molport-001-757-123 [0,0,1,0,0,0|2,0,1]=4 79 B10R2.178 O=C1NCC2CCC1C2 Molport-029-001-391 [0,0,0,1,0,0|3,0,0]=4 80 B10R2.348 O=C(O)C12CC(C1)CN2 Molport-005-312-831 [0,0,0,1,0,0|1,0,0]=2 81 B10R2.355 O=C(O)[C@@H]1NC[C@H]2[C@@H]1C2 Molport-020-313-507 [0,0,0,1,0,0|1,0,0]=2 82 B10R2.355 O=C(O)[C@H]1NCC2C1C2 Molport-002-885-967 [0,0,0,1,0,0|1,0,0]=2 83 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 Molport-002-472-176 [0,0,0,1,0,0|1,0,0]=2 84 B8R1.23 C=C1CC(C1)C(=O)O Molport-001-769-523 [0,0,0,0,1,0|1,0,1]=3 85 B8R1.23 CC(=O)N1CC(C1)N Molport-030-085-716 [0,0,0,0,1,0|3,0,0]=4 86 B8R1.23 O=C1CC(C1)C(=O)O Molport-000-876-904 [0,0,0,0,1,0|0,0,2]=3 87 B8R1.23 O=C1CC(N1)C(=O)O Molport-016-578-545 [0,0,0,0,1,0|0,0,2]=3 88 B10R1.13 C=C1CCC(CC1)C(=O)O Molport-009-196-248 [0,0,0,0,0,1|2,0,1]=4 89 B10R1.13 CC1=CCC(CC1)C(=O)O Molport-022-366-438 [0,0,0,0,0,1|2,0,1]=4 90 B10R1.13 CC1CCC(CC1)C(=O)O Molport-002-995-998 [0,0,0,0,0,1|2,0,0]=3 91 B10R1.13 NC(=O)C1CCC(CC1)N Molport-009-470-899 [0,0,0,0,0,1|3,0,0]=4 92 B10R1.13 NC1CCC(CC1)C(=O)O Molport-002-473-430 [0,0,0,0,0,1|2,0,0]=3 93 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O Molport-001-767-837 [0,0,0,0,0,1|2,0,0]=3 94 B10R1.13 O=C(O)C1CCC(CN1)O Molport-018-618-293 [0,0,0,0,0,1|0,0,0]=1 95 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O Molport-005-942-243 [0,0,0,0,0,1|0,0,0]=1 96 B10R1.13 O=C1CCC(CC1)C(=O)O Molport-000-127-797 [0,0,0,0,0,1|1,0,2]=4 97 B10R1.13 O=C1CCC(CN1)C(=O)O Molport-004-346-573 [0,0,0,0,0,1|1,0,2]=4 98 B10R1.13 O=C1CNC(CN1)C(=O)O Molport-038-386-786 [0,0,0,0,0,1|0,0,2]=3 99 B10R1.54 O=C(O)CN1CCC(C1)O Molport-027-835-328 [0,0,0,0,0,1|2,0,0]=3 100 B10R1.113 CC1CC(CCO1)C(=O)O Molport-002-515-478 [0,0,0,0,0,1|2,0,0]=3 101 B10R1.113 CC1CCCC(C1)C(=O)O Molport-001-791-799 [0,0,0,0,0,1|2,0,0]=3 102 B10R1.113 CC1CCCC(N1)C(=O)O Molport-016-578-936 [0,0,0,0,0,1|3,0,0]=4 103 B10R1.113 CN1CCCC(C1)C(=O)O Molport-001-769-338 [0,0,0,0,0,1|3,0,0]=4 104 B10R1.113 NC1CCCC(C1)C(=O)O Molport-000-150-999 [0,0,0,0,0,1|2,0,0]=3 105 B10R1.113 O=C1CC(CNN1)C(=O)O Molport-028-956-950 [0,0,0,0,0,1|1,0,2]=4 106 B7R0.3 C=CCCC(C)CN Molport-021-452-967 [1,0,1,0,0,0|2,0,0]=4 107 B7R0.3 C=CCCC(C)CN Molport-046-425-328 [1,0,1,0,0,0|2,0,0]=4 108 B7R0.3 CC(CO)NCCO Molport-009-204-662 [1,0,1,0,0,0|0,0,1]=3 109 B7R0.3 CCCNC(C)CO Molport-015-081-622 [1,0,1,0,0,0|1,0,1]=4 110 B7R0.3 CSCCC(O)CN Molport-021-604-943 [1,0,1,0,0,0|2,0,0]=4 111 B7R0.4 C#CCNCC(=O)O Molport-038-942-518 [1,0,1,0,0,0|0,0,2]=4 112 B7R0.4 C=CCNCC(C)C Molport-003-726-538 [1,0,1,0,0,0|2,0,0]=4 113 B7R0.4 C=CCNCC(C)C Molport-009-676-786 [1,0,1,0,0,0|2,0,0]=4 114 B7R0.4 CC(=O)NCCCN Molport-004-356-170 [1,0,1,0,0,0|2,0,0]=4 115 B7R0.4 CCC/C=C\C(=O)O Molport-005-909-359 [1,0,1,0,0,0|1,0,1]=4 116 B7R0.4 CCCCCC(=O)C Molport-001-759-309 [1,0,1,0,0,0|2,0,0]=4 117 B7R0.4 CCCOCC(=O)O Molport-009-200-571 [1,0,1,0,0,0|1,0,0]=3 118 B7R0.4 CNCCCC(=O)O Molport-003-928-816 [1,0,1,0,0,0|2,0,0]=4 119 B7R0.4 CSCCCC(=O)O Molport-011-008-648 [1,0,1,0,0,0|2,0,0]=4 120 B7R0.4 N#CCCCC(=O)O Molport-020-180-062 [1,0,1,0,0,0|0,0,2]=4 121 B7R0.4 NCCCCC(=O)O Molport-003-666-360 [1,0,1,0,0,0|0,0,0]=2 122 B7R0.4 NCCSCC(=O)O Molport-023-137-056 [1,0,1,0,0,0|1,0,0]=3 123 B7R0.4 NOCCCC(=O)O Molport-027-844-893 [1,0,1,0,0,0|1,0,0]=3 124 B7R0.4 O=C(O)C#CCCO Molport-038-344-934 [1,0,1,0,0,0|1,0,1]=4 125 B7R0.4 O=C(O)CCCCS Molport-013-659-967 [1,0,1,0,0,0|1,0,0]=3 126 B7R0.5 C=CCC(N)C(=O)O Molport-001-792-376 [1,0,1,0,0,0|0,0,2]=4 127 B7R0.5 C=CC[C@@H](N)C(=O)O Molport-001-758-814 [1,0,1,0,0,0|0,0,2]=4 128 B7R0.5 CC(=O)N(C)CCO Molport-008-154-444 [1,0,1,0,0,0|2,0,0]=4 129 B7R0.5 CCC[C@@H](N)C(=O)O Molport-001-792-138 [1,0,1,0,0,0|0,0,0]=2 130 B7R0.5 CCNC(=O)C(=O)O Molport-012-651-515 [1,0,1,0,0,0|1,0,1]=4 131 B7R0.5 CCOC(C)C(=O)O Molport-004-341-569 [1,0,1,0,0,0|1,0,0]=3 132 B7R0.5 CNCC(C)C(=O)O Molport-016-635-341 [1,0,1,0,0,0|2,0,0]=4 133 B7R0.5 COCC(N)C(=O)O Molport-019-996-008 [1,0,1,0,0,0|1,0,0]=3 134 B7R0.5 C[Se]CC(N)C(=O)O Molport-005-941-812 [1,0,1,0,0,0|1,0,0]=3 135 B7R0.5 C[Se]C[C@H](N)C(=O)O Molport-044-560-454 [1,0,1,0,0,0|1,0,0]=3 136 B7R0.5 NCCC(N)C(=O)O Molport-006-069-148 [1,0,1,0,0,0|1,0,0]=3 137 B7R0.5 NCC[C@@H](N)C(=O)O Molport-005-938-074 [1,0,1,0,0,0|1,0,0]=3 138 B7R0.5 N[C@H](CCS)C(=O)O Molport-020-237-559 [1,0,1,0,0,0|0,1,0]=3 139 B7R0.6 CC(C)NCC(=O)O Molport-002-472-582 [1,0,1,0,0,0|2,0,0]=4 140 B7R0.6 CC(C)OCC(=O)O Molport-002-683-574 [1,0,1,0,0,0|2,0,0]=4 141 B7R0.6 CC(C)SCC(=O)O Molport-000-679-256 [1,0,1,0,0,0|2,0,0]=4 142 B7R0.6 CN(C)CCC(=O)O Molport-001-790-337 [1,0,1,0,0,0|2,0,0]=4 143 B7R0.6 O=[13C](O)CC[13C](=O)O Molport-003-934-537 [1,0,1,0,0,0|1,0,1]=4 144 B7R0.15 CCC(NC)C(=O)N Molport-011-903-568 [1,0,1,0,0,0|1,0,0]=3 145 B7R0.15 CCC(NC)C(=O)O Molport-011-836-124 [1,0,1,0,0,0|0,0,0]=2 146 B7R0.15 CCC(NC)C(=O)O Molport-016-634-445 [1,0,1,0,0,0|0,0,0]=2 147 B7R0.15 CCC(OC)C(=O)N Molport-002-779-176 [1,0,1,0,0,0|2,0,0]=4 148 B7R0.15 CNC(CO)C(=O)O Molport-019-998-723 [1,0,1,0,0,0|0,0,0]=2 149 B7R0.15 COC(CN)C(=O)O Molport-027-844-961 [1,0,1,0,0,0|2,0,0]=4 150 B7R1.1 C#C[C@@H]1CCCN1 Molport-035-776-851 [2,0,0,0,0,0|1,0,1]=4 151 B7R1.1 CCC1CCCN1 Molport-000-003-688 [2,0,0,0,0,0|1,0,1]=4 152 B7R1.1 ClCC1CCCN1 Molport-035-716-508 [2,0,0,0,0,0|1,0,1]=4 153 B7R1.1 FCC1CCCN1 Molport-019-930-688 [2,0,0,0,0,0|1,0,1]=4 154 B7R1.1 O=CC1CCOC1 Molport-001-794-100 [2,0,0,0,0,0|2,0,0]=4 155 B7R1.1 O=CN1CCCC1 Molport-002-501-742 [2,0,0,0,0,0|2,0,0]=4 156 B7R1.1 OCC1CCCO1 Molport-001-782-161 [2,0,0,0,0,0|1,0,1]=4 157 B7R1.1 OC[C@@H]1CCCO1 Molport-006-708-170 [2,0,0,0,0,0|1,0,1]=4 158 B7R1.1 OC[C@H]1CCCN1 Molport-000-139-019 [2,0,0,0,0,0|0,0,1]=3 159 B7R1.2 C[C@@H]1CNC(=O)C1 Molport-027-948-657 [2,0,0,0,0,0|1,0,1]=4 160 B7R1.2 NC1CNC(=O)C1 Molport-021-874-657 [2,0,0,0,0,0|1,0,1]=4 161 B7R1.2 N[C@@H]1CC[C@@H](C1)O Molport-023-333-453 [2,0,0,0,0,0|2,0,0]=4 162 B7R1.2 N[C@H]1CC[C@H](C1)O Molport-009-684-879 [2,0,0,0,0,0|2,0,0]=4 163 B7R1.2 N[C@H]1CNC(=O)C1 Molport-039-330-473 [2,0,0,0,0,0|1,0,1]=4 164 B7R1.2 O=C1CC(CN1)O Molport-019-904-308 [2,0,0,0,0,0|0,0,1]=3 165 B7R1.2 O=C1C[C@@H](CO1)O Molport-001-793-714 [2,0,0,0,0,0|1,0,1]=4 166 B9R0.7 CC(NCC(=O)O)C(=O)O Molport-003-355-448 [0,1,1,0,0,0|0,0,1]=3 167 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Molport-004-773-539 [0,1,1,0,0,0|1,0,1]=4 168 B9R0.47 CC(NCCC#N)C(=O)O Molport-003-905-741 [0,1,1,0,0,0|1,0,0]=3 169 B9R0.47 N[C@@H](CCCNO)C(=O)O Molport-042-668-512 [0,1,1,0,0,0|2,0,0]=4 170 B9R0.48 CCCC(N)CCC(=O)O Molport-046-681-925 [0,1,1,0,0,0|2,0,0]=4 171 B9R0.12 CNC(=O)C(CCO)NC Molport-020-180-253 [0,1,1,0,0,0|1,0,0]=3 172 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Molport-003-925-252 [0,1,1,0,0,0|1,0,0]=3 173 B9R0.74 CCCC(C)(CC)C(=O)O Molport-006-116-800 [0,1,1,0,0,0|2,0,0]=4 174 B9R0.11 CC(C)CC(C)(F)C(=O)O Molport-029-703-339 [0,1,1,0,0,0|2,0,0]=4 175 B9R0.11 CC(C)CC(C)(O)C(=O)O Molport-014-557-353 [0,1,1,0,0,0|2,0,0]=4 176 B9R0.11 CN(C)CC(C)(N)C(=O)O Molport-012-541-382 [0,1,1,0,0,0|2,0,0]=4 177 B9R0.57 NC(CC(F)(F)F)C(=O)O Molport-000-151-260 [0,1,1,0,0,0|2,0,0]=4 178 B9R0.57 NC(CC(F)(F)F)C(=O)O Molport-001-775-944 [0,1,1,0,0,0|2,0,0]=4 179 B9R0.79 CC(O)C(C)C(N)C(=O)O Molport-003-990-783 [0,1,1,0,0,0|0,0,0]=2 180 B9R0.53 CC(C)CC(O)CC(=O)O Molport-008-643-782 [0,1,1,0,0,0|2,0,0]=4 181 B9R0.53 CC(O)CN(C)CC(C)O Molport-006-116-177 [0,1,1,0,0,0|1,0,1]=4 182 B9R0.53 NN(CC(=O)O)CC(=O)O Molport-001-789-075 [0,1,1,0,0,0|1,0,1]=4 183 B9R1.133 OCC1CC(CN1)(F)F Molport-028-951-688 [1,1,0,0,0,0|1,0,1]=4 184 B9R1.11 CNC(=O)[C@@H]1CCCN1 Molport-009-653-480 [1,1,0,0,0,0|1,0,0]=3 185 B9R1.11 CNC(=O)[C@@H]1CCCN1 Molport-020-004-550 [1,1,0,0,0,0|1,0,0]=3 186 B9R1.11 CNC(=O)[C@H]1CCCN1 Molport-029-998-167 [1,1,0,0,0,0|1,0,0]=3 187 B9R1.11 COC(=O)C1=CCCC1 Molport-002-041-371 [1,1,0,0,0,0|1,0,1]=4 188 B9R1.11 COC(=O)C1C=CCN1 Molport-003-941-091 [1,1,0,0,0,0|0,0,2]=4 189 B9R1.11 COC(=O)C1CCCC1 Molport-003-896-112 [1,1,0,0,0,0|1,0,0]=3 190 B9R1.11 COC(=O)C1CCCN1 Molport-001-760-766 [1,1,0,0,0,0|0,0,0]=2 191 B9R1.11 COC(=O)C1CCCN1 Molport-002-780-203 [1,1,0,0,0,0|0,0,0]=2 192 B9R1.11 COC(=O)C1CCNC1 Molport-000-004-545 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.11 N/C(=N\O)/C1CCCC1 Molport-000-003-953 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.11 NCC(=O)C1CCCC1 Molport-044-195-754 [1,1,0,0,0,0|2,0,0]=4 195 B9R1.11 NNC(=O)C1CCCC1 Molport-000-887-176 [1,1,0,0,0,0|2,0,0]=4 196 B9R1.11 NNC(=O)C1CCCO1 Molport-004-301-123 [1,1,0,0,0,0|2,0,0]=4 197 B9R1.11 O=C(NO)C1=CCCC1 Molport-046-628-958 [1,1,0,0,0,0|1,0,1]=4 198 B9R1.41 CC(=O)C1CCCC1=O Molport-001-790-293 [1,1,0,0,0,0|2,0,0]=4 199 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Molport-004-778-402 [1,1,0,0,0,0|1,0,0]=3 200 B9R1.163 CC(=O)C1(CCCC1)N Molport-035-716-321 [1,1,0,0,0,0|2,0,0]=4 201 B9R1.163 CC1(CCCN1)C(=O)N Molport-020-263-836 [1,1,0,0,0,0|1,0,0]=3 202 B9R1.163 CC1(CCCN1)C(=O)O Molport-023-313-650 [1,1,0,0,0,0|0,0,0]=2 203 B9R1.163 CC1(CCCO1)C(=O)O Molport-002-679-053 [1,1,0,0,0,0|1,0,0]=3 204 B9R1.163 CC1(CCNC1)C(=O)O Molport-000-004-626 [1,1,0,0,0,0|2,0,0]=4 205 B9R1.163 C[C@@]1(CCCN1)C(=O)O Molport-028-960-121 [1,1,0,0,0,0|0,0,0]=2 206 B9R1.163 O=C(O)C1(CCNC1)F Molport-044-730-080 [1,1,0,0,0,0|2,0,0]=4 207 B9R1.163 [2H]C1(CCCN1)C(=O)O Molport-051-798-955 [1,1,0,0,0,0|0,0,0]=2 208 B9R1.82 COC(=O)C1CC(=O)C1 Molport-015-163-768 [0,1,0,0,1,0|0,0,2]=4 209 B9R1.82 COC(=O)[C@H]1C[C@@H](C1)N Molport-016-637-659 [0,1,0,0,1,0|1,0,0]=3 210 B9R1.82 COC(=O)[C@H]1C[C@H](C1)N Molport-005-314-001 [0,1,0,0,1,0|1,0,0]=3 211 B9R1.82 O=C(CCl)N1CC(C1)O Molport-037-051-658 [0,1,0,0,1,0|2,0,0]=4 212 B9R1.164 CC1(CC(C1)C(=O)N)C Molport-028-847-234 [0,1,0,0,1,0|2,0,0]=4 213 B9R1.164 CC1(CC(C1)C(=O)O)C Molport-019-906-269 [0,1,0,0,1,0|1,0,0]=3 214 B11R1.3 CCC1CCC(CC1)C(=O)O Molport-002-857-360 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)O Molport-003-984-512 [0,1,0,0,0,1|2,0,0]=4 216 B11R1.21 CN1CC(NCC1=O)C(=O)O Molport-044-856-277 [0,1,0,0,0,1|0,0,2]=4 217 B11R1.21 N[C@H]1CC[C@H](C[C@@H]1O)C(=O)O Molport-047-526-215 [0,1,0,0,0,1|2,0,0]=4 218 B11R1.21 N[C@H]1C[C@@H](CC[C@@H]1O)C(=O)O Molport-047-523-933 [0,1,0,0,0,1|1,0,0]=3 219 B11R1.22 COC(=O)C1CNC(=O)CN1 Molport-047-367-751 [0,1,0,0,0,1|0,0,2]=4 220 B11R1.727 O=C(O)C1CCC(CC1)(F)F Molport-000-160-191 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.23 COC(=O)C1CC(CCN1)C Molport-028-766-788 [0,1,0,0,0,1|1,0,0]=3 222 B11R1.23 COC(=O)N1CCCC(C1)O Molport-006-067-189 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O Molport-004-781-347 [0,1,0,0,0,1|0,0,0]=2 224 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O Molport-008-155-597 [0,1,0,0,0,1|0,0,0]=2 225 B11R1.74 C[C@@H]1C[C@H](NC(=S)N1)C(=O)O Molport-016-583-473 [0,1,0,0,0,1|1,0,1]=4 226 B11R1.730 CC1(CC(CCO1)C(=O)O)C Molport-001-794-991 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.730 CC1(CNCC(O1)C(=O)O)C Molport-046-672-995 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.15 CCOC(=O)C1CC(CN1)O Molport-000-131-070 [0,2,0,0,0,0|0,0,0]=2 229 B11R1.15 CCOC(=O)[C@@H]1C[C@H](CN1)O Molport-020-004-677 [0,2,0,0,0,0|0,0,0]=2 230 B11R1.866 COC(=O)C1CC(CN1)(F)F Molport-035-771-859 [0,2,0,0,0,0|1,0,0]=3 231 B11R1.175 O=C(O)C1CCC(C1)C(=O)O Molport-000-480-274 [0,2,0,0,0,0|1,0,0]=3 232 B11R1.175 O=C(O)[C@H]1CC[C@H](C1)C(=O)O Molport-023-213-308 [0,2,0,0,0,0|1,0,0]=3 233 B11R1.489 C[N+]1(C[C@H](C[C@@H]1C(=O)[O-])O)C Molport-046-854-427 [0,2,0,0,0,0|0,0,2]=4 234 B9R1.6 CC(=O)C1CCCCN1 Molport-023-332-399 [0,0,1,1,0,0|2,0,0]=4 235 B9R1.6 NC(=O)C1CCCCN1 Molport-002-467-271 [0,0,1,1,0,0|2,0,0]=4 236 B9R1.6 NC(=O)C1CCCCN1 Molport-005-310-643 [0,0,1,1,0,0|2,0,0]=4 237 B9R1.6 NC(=O)C1CCCOC1 Molport-006-067-188 [0,0,1,1,0,0|2,0,0]=4 238 B9R1.6 O=C(O)C1CCCOC1 Molport-005-306-561 [0,0,1,1,0,0|1,0,0]=3 239 B9R1.6 O=C(O)C1CCSCN1 Molport-028-956-724 [0,0,1,1,0,0|2,0,0]=4 240 B9R1.6 O=C(O)C1CNCCN1 Molport-000-141-392 [0,0,1,1,0,0|1,0,0]=3 241 B9R1.6 O=C(O)C1CNCCN1 Molport-001-768-421 [0,0,1,1,0,0|1,0,0]=3 242 B9R1.6 O=C(O)C1CNCCO1 Molport-000-004-696 [0,0,1,1,0,0|2,0,0]=4 243 B9R1.6 O=C(O)C1CSCCN1 Molport-000-006-313 [0,0,1,1,0,0|0,1,0]=3 244 B9R1.6 O=C(O)[C@@H]1CCCCN1 Molport-002-498-081 [0,0,1,1,0,0|1,0,0]=3 245 B9R1.6 O=C(O)[C@@H]1CCCNC1 Molport-001-770-212 [0,0,1,1,0,0|2,0,0]=4 246 B9R1.6 O=C(O)[C@H]1CNCCN1 Molport-000-005-914 [0,0,1,1,0,0|1,0,0]=3 247 B9R1.69 C[C@@H]1NC[C@H](NC1=O)C Molport-035-385-694 [0,0,1,1,0,0|2,0,0]=4 248 B9R1.127 CCC1(CC1C(=O)O)C Molport-013-638-378 [0,0,1,1,0,0|2,0,0]=4 249 B9R1.147 CC1(CC1)CCC(=O)O Molport-003-178-985 [0,0,1,1,0,0|2,0,0]=4 250 B9R1.33 O=C1OCCN1CCO Molport-002-501-616 [0,0,1,1,0,0|2,0,0]=4 251 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 Molport-035-385-693 [1,0,0,1,0,0|1,0,0]=3 252 B9R2.145 O=C(O)C12CC(C1)C2 Molport-029-996-104 [0,0,0,1,1,0|1,0,0]=3 253 B11R2.845 O=C(O)C1CC2CCC1C2 Molport-001-623-618 [0,0,0,1,0,1|2,0,0]=4 254 B11R2.901 COC(=O)C12CC(C1)CN2 Molport-035-942-710 [0,1,0,1,0,0|1,0,0]=3 255 B7R0.16 CC(C)C(Br)C(=O)O Molport-000-152-206 [0,0,1,0,1,0|2,0,0]=4 256 B7R0.16 CC(C)C(N)C(=O)N Molport-004-342-622 [0,0,1,0,1,0|2,0,0]=4 257 B7R0.16 CC(C)[C@H](N)[13C](=O)O Molport-051-561-857 [0,0,1,0,1,0|1,0,0]=3 258 B7R1.10 CSC1CC(C1)O Molport-044-636-351 [1,0,0,0,1,0|2,0,0]=4 259 B7R1.18 NC(=O)C1CCC1 Molport-003-873-345 [1,0,0,0,1,0|1,0,0]=3 260 B7R1.18 NC(=O)C1CNC1 Molport-015-163-863 [1,0,0,0,1,0|2,0,0]=4 261 B7R1.18 OB(O)C1CCC1 Molport-003-938-221 [1,0,0,0,1,0|1,0,1]=4 262 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Molport-006-109-402 [0,0,0,0,2,0|1,0,0]=3 263 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Molport-028-948-974 [0,0,0,0,2,0|1,0,0]=3 264 B7R1.12 O=C(O)[C@H]1C[C@H]1F Molport-006-709-707 [0,0,0,0,2,0|1,0,0]=3 265 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O Molport-046-069-161 [1,0,0,0,0,1|1,0,1]=4 266 B9R1.13 NC(=O)/N=C/1\CCCN1 Molport-028-607-794 [1,0,0,0,0,1|1,0,1]=4 267 B9R1.13 O=C(Cl)OC1CCCC1 Molport-001-756-926 [1,0,0,0,0,1|2,0,0]=4 268 B9R1.13 O=C(O)CC1CCCC1 Molport-001-769-833 [1,0,0,0,0,1|1,0,0]=3 269 B9R1.13 O=C(O)CC1CCCO1 Molport-001-782-213 [1,0,0,0,0,1|1,0,0]=3 270 B9R1.13 O=C(O)CC1CCNC1 Molport-001-729-044 [1,0,0,0,0,1|2,0,0]=4 271 B9R1.13 O=C(O)CC1OCCO1 Molport-028-951-481 [1,0,0,0,0,1|2,0,0]=4 272 B9R1.13 O=C(O)CN1CCCC1 Molport-000-510-248 [1,0,0,0,0,1|2,0,0]=4 273 B9R1.13 O=C(O)CN1CCCC1 Molport-001-769-272 [1,0,0,0,0,1|2,0,0]=4 274 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O Molport-020-249-386 [0,0,0,0,0,2|2,0,0]=4