0 B8R0.28 CC(C)CNCC(=O)O Molport-005-231-062 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.28 CC(O)CNCC(C)O Molport-001-789-470 [0,0,0,0,0,0|2,0,2]=4 2 B8R0.28 CN(C)CCCC(=O)O Molport-001-792-192 [0,0,0,0,0,0|4,0,0]=4 3 B8R0.28 CN(C)CCCC(=O)O Molport-003-928-817 [0,0,0,0,0,0|4,0,0]=4 4 B8R0.28 N=C(N)SCCC(=O)O Molport-001-786-569 [0,0,0,0,0,0|4,0,0]=4 5 B8R0.28 NC(=O)CCCC(=O)N Molport-028-749-554 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.28 O=C(O)COCC(=O)O Molport-003-926-440 [0,0,0,0,0,0|1,0,0]=1 7 B8R0.28 O=C(O)CSCC(=O)O Molport-001-757-123 [0,0,0,0,0,0|1,0,0]=1 8 B7R0.4 C#CCNCC(=O)O Molport-038-942-518 [1,0,0,0,0,0|1,0,1]=3 9 B7R0.4 C#CCOCC(=O)O Molport-007-991-490 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.4 C=CCNCC(=C)Br Molport-001-656-221 [1,0,0,0,0,0|3,0,0]=4 11 B7R0.4 C=CCNCC(=C)Br Molport-029-906-634 [1,0,0,0,0,0|3,0,0]=4 12 B7R0.4 C=CCSCC(=O)O Molport-000-150-911 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.4 CCCOCC(=O)O Molport-009-200-571 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.4 CNCCCC(=O)O Molport-003-928-816 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.4 CSCCCC(=O)O Molport-011-008-648 [1,0,0,0,0,0|3,0,0]=4 16 B7R0.4 N#CCCCC(=O)O Molport-020-180-062 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.4 NCCCCC(=O)O Molport-003-666-360 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.4 NCCSCC(=O)O Molport-023-137-056 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.4 NOCCCC(=O)O Molport-027-844-893 [1,0,0,0,0,0|3,0,0]=4 20 B7R0.4 O=C(O)C#CCCO Molport-038-344-934 [1,0,0,0,0,0|1,0,2]=4 21 B7R0.4 O=C(O)CCCCS Molport-013-659-967 [1,0,0,0,0,0|1,1,1]=4 22 B9R0.1 COC(=O)CCCC(=O)Cl Molport-001-791-498 [0,1,0,0,0,0|2,0,0]=3 23 B9R0.1 COC(=O)CCC[N+](=O)[O-] Molport-002-731-230 [0,1,0,0,0,0|2,0,1]=4 24 B9R0.1 COC(=O)CCNC(=O)N Molport-011-966-246 [0,1,0,0,0,0|3,0,0]=4 25 B9R0.1 COC(=O)CSCC(=O)C Molport-002-886-483 [0,1,0,0,0,0|2,0,0]=3 26 B9R0.1 NCC(=O)CCCC(=O)O Molport-021-780-066 [0,1,0,0,0,0|2,0,0]=3 27 B9R0.1 O=C(O)CCNC(=O)CCl Molport-001-766-268 [0,1,0,0,0,0|3,0,0]=4 28 B9R0.7 CC(=O)C(C)CCC(=O)O Molport-002-131-365 [0,1,0,0,0,0|2,0,0]=3 29 B9R0.7 CC(=O)C(C)CCC(=O)[O-] Molport-051-541-961 [0,1,0,0,0,0|2,0,1]=4 30 B9R0.7 CC(=O)SCC(C)C(=O)O Molport-002-893-880 [0,1,0,0,0,0|3,0,0]=4 31 B9R0.7 CC(NCC(=O)O)C(=O)O Molport-003-355-448 [0,1,0,0,0,0|0,0,0]=1 32 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Molport-046-925-996 [0,1,0,0,0,0|3,0,0]=4 33 B9R0.7 NC(=O)CC[C@H]([15NH2])C(=O)O Molport-003-934-621 [0,1,0,0,0,0|2,0,0]=3 34 B9R0.7 NC(CCC(=O)O)C(=O)O Molport-002-130-089 [0,1,0,0,0,0|1,0,0]=2 35 B9R0.7 N[C@@H](CCC(=O)O)C(O)O Molport-047-739-939 [0,1,0,0,0,0|1,0,2]=4 36 B9R0.7 N[C@@H](CCC(=O)[15NH2])C(=O)O Molport-003-934-620 [0,1,0,0,0,0|2,0,0]=3 37 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O Molport-001-795-061 [0,1,0,0,0,0|1,0,1]=3 38 B9R0.7 O=C(O)CCC(=O)C(=O)O Molport-002-322-422 [0,1,0,0,0,0|1,0,1]=3 39 B9R0.7 O=C(O)CCC(=O)C(=O)O Molport-003-941-878 [0,1,0,0,0,0|1,0,1]=3 40 B9R0.7 O=C(O)CC[C@H](O)C(=O)O Molport-046-683-545 [0,1,0,0,0,0|1,0,0]=2 41 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] Molport-051-786-212 [0,1,0,0,0,0|1,0,2]=4 42 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(=O)O Molport-042-682-386 [0,1,0,0,0,0|2,0,0]=3 43 B9R0.53 NN(CC(=O)O)CC(=O)O Molport-001-789-075 [0,1,0,0,0,0|0,0,0]=1 44 B9R0.56 CS(=O)(=O)CCCC(=O)O Molport-011-192-190 [0,1,0,0,0,0|2,0,1]=4 45 B9R1.35 CC1=CC(SC1)C(=O)O Molport-016-583-556 [0,0,0,1,0,0|3,0,0]=4 46 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O Molport-023-219-522 [0,0,0,1,0,0|2,0,1]=4 47 B9R1.35 NC1CNC(C1)C(=O)O Molport-028-600-683 [0,0,0,1,0,0|2,0,1]=4 48 B9R1.35 O=C(O)C1=CC(=NN1)O Molport-019-938-315 [0,0,0,1,0,0|2,0,1]=4 49 B9R1.35 O=C(O)C1=NC(=NN1)O Molport-019-908-660 [0,0,0,1,0,0|2,0,1]=4 50 B9R1.35 O=C1C=C(NN1)C(=O)O Molport-002-508-234 [0,0,0,1,0,0|2,0,1]=4 51 B9R1.35 O=C1CC(CN1)C(=O)O Molport-000-005-185 [0,0,0,1,0,0|3,0,0]=4 52 B9R1.35 O=C1CC(NN1)C(=O)O Molport-022-365-593 [0,0,0,1,0,0|2,0,0]=3 53 B9R1.35 O=C1C[C@@H](CN1)C(=O)O Molport-035-868-754 [0,0,0,1,0,0|3,0,0]=4 54 B9R1.35 O=C1N=C(NN1)C(=O)O Molport-004-411-897 [0,0,0,1,0,0|2,0,1]=4 55 B9R1.35 O=C1NCC(O1)C(=O)O Molport-023-313-073 [0,0,0,1,0,0|2,0,0]=3 56 B9R1.35 O=C1NC[C@H](N1)C(=O)O Molport-004-963-012 [0,0,0,1,0,0|3,0,0]=4 57 B9R1.35 O=C1N[C@H](CS1)C(=O)O Molport-002-509-226 [0,0,0,1,0,0|3,0,0]=4 58 B9R1.53 O=C(O)CC1CC(=O)C1 Molport-039-070-762 [0,0,0,1,0,0|2,0,0]=3 59 B9R1.161 O=C(O)C1CC1C(=O)O Molport-003-711-390 [0,0,0,1,0,0|1,0,0]=2 60 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O Molport-027-837-330 [0,0,0,1,0,0|1,0,0]=2 61 B7R0.6 CC(=O)CCC(=O)C Molport-000-871-964 [0,0,0,0,1,0|2,0,0]=3 62 B7R0.6 CC(=O)CNC(=O)C Molport-000-005-232 [0,0,0,0,1,0|2,0,0]=3 63 B7R0.6 CC(C)NCC(=O)O Molport-002-472-582 [0,0,0,0,1,0|2,0,1]=4 64 B7R0.6 CN(C)CCC(=O)O Molport-001-790-337 [0,0,0,0,1,0|3,0,0]=4 65 B7R0.6 N=C(N)SCC(=O)O Molport-000-699-274 [0,0,0,0,1,0|3,0,0]=4 66 B7R0.6 N=C(N)SCC(=O)O Molport-035-874-358 [0,0,0,0,1,0|3,0,0]=4 67 B7R0.6 NC(=O)CCC(=O)N Molport-000-656-261 [0,0,0,0,1,0|2,0,0]=3 68 B7R0.6 NC(=O)CNC(=S)N Molport-011-497-601 [0,0,0,0,1,0|2,1,0]=4 69 B7R0.6 NC(=O)NCC(=O)O Molport-000-894-377 [0,0,0,0,1,0|1,0,0]=2 70 B7R0.6 O=C(O)C#CC(=O)O Molport-001-779-893 [0,0,0,0,1,0|0,0,2]=3 71 B7R0.6 O=C([O-])C#CC(=O)O Molport-001-759-269 [0,0,0,0,1,0|0,0,3]=4 72 B7R0.6 O=C([O-])[13CH2][13CH2]C(=O)[O-] Molport-051-992-875 [0,0,0,0,1,0|0,0,2]=3 73 B7R0.6 O=[13C](O)CC[13C](=O)O Molport-003-934-537 [0,0,0,0,1,0|0,0,0]=1 74 B9R0.55 CC(=O)CCCOC(=O)C Molport-001-790-649 [0,0,0,0,0,1|3,0,0]=4 75 B9R0.55 NC(=O)CCCCC(=O)N Molport-000-872-078 [0,0,0,0,0,1|3,0,0]=4 76 B9R0.55 NC(=O)NCCCC(=O)O Molport-000-713-206 [0,0,0,0,0,1|2,0,0]=3 77 B6R0.4 C=CCNC(=O)C Molport-006-112-291 [2,0,0,0,0,0|2,0,0]=4 78 B6R0.4 C=CCNC(=O)N Molport-001-495-582 [2,0,0,0,0,0|2,0,0]=4 79 B6R0.4 CNCCC(=O)O Molport-009-286-472 [2,0,0,0,0,0|2,0,0]=4 80 B6R0.4 COCCC(=O)O Molport-001-794-152 [2,0,0,0,0,0|2,0,0]=4 81 B6R0.4 O=C(O)/C=C/CO Molport-000-004-126 [2,0,0,0,0,0|1,0,1]=4 82 B6R0.6 C=CCNCC=C Molport-001-779-723 [2,0,0,0,0,0|2,0,0]=4 83 B6R0.6 O=CCCCC=O Molport-001-781-859 [2,0,0,0,0,0|1,0,0]=3 84 B8R0.6 C=CCSCC(=O)OC Molport-002-039-924 [1,1,0,0,0,0|2,0,0]=4 85 B8R0.6 COC(=O)CCCCO Molport-039-142-172 [1,1,0,0,0,0|1,0,1]=4 86 B8R0.7 C/C=C/CCCC(=O)O Molport-022-365-475 [1,1,0,0,0,0|2,0,0]=4 87 B8R0.7 CC(=O)CCCOC=O Molport-002-704-977 [1,1,0,0,0,0|2,0,0]=4 88 B8R0.7 CCCNCCC(=O)O Molport-002-472-204 [1,1,0,0,0,0|1,0,1]=4 89 B8R0.7 CCCNCCC(=O)O Molport-019-922-357 [1,1,0,0,0,0|1,0,1]=4 90 B8R0.7 COCCOCC(=O)O Molport-001-791-765 [1,1,0,0,0,0|1,0,1]=4 91 B8R0.7 COCCOCC(=O)O Molport-053-122-888 [1,1,0,0,0,0|1,0,1]=4 92 B8R0.7 N#CCCNCC(=O)O Molport-001-793-057 [1,1,0,0,0,0|1,0,1]=4 93 B8R0.7 NOCCCCC(=O)O Molport-052-006-562 [1,1,0,0,0,0|1,0,1]=4 94 B8R0.8 C=CCCC(C)C(=O)O Molport-022-365-513 [1,1,0,0,0,0|2,0,0]=4 95 B8R0.9 C=CC(N)CCC(=O)O Molport-039-240-479 [1,1,0,0,0,0|2,0,0]=4 96 B8R0.23 CC(=O)CC(N)C(=O)O Molport-023-314-128 [0,1,0,0,1,0|1,0,0]=3 97 B8R0.23 CC(=O)NC(C)C(=O)C Molport-001-781-700 [0,1,0,0,1,0|2,0,0]=4 98 B8R0.23 CC(=O)NC(C)C(=O)O Molport-001-791-849 [0,1,0,0,1,0|1,0,0]=3 99 B8R0.23 CC(NC(=O)N)C(=O)O Molport-001-794-441 [0,1,0,0,1,0|1,0,0]=3 100 B8R0.23 CN(CC(=O)O)C(=O)N Molport-002-470-227 [0,1,0,0,1,0|1,0,0]=3 101 B8R0.23 NC(CS(=O)O)C(=O)O Molport-002-512-295 [0,1,0,0,1,0|1,0,0]=3 102 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Molport-035-865-273 [0,1,0,0,1,0|0,0,1]=3 103 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)[O-] Molport-023-221-766 [0,1,0,0,1,0|0,0,2]=4 104 B8R0.23 O=C(O)CC(S)C(=O)O Molport-001-763-895 [0,1,0,0,1,0|0,0,0]=2 105 B8R0.23 O=C(O)CC(S)C(=O)O Molport-051-552-437 [0,1,0,0,1,0|0,0,0]=2 106 B8R0.23 O=C([O-])CC(O)C(=O)O Molport-051-568-515 [0,1,0,0,1,0|0,0,1]=3 107 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(=O)O Molport-003-934-579 [0,1,0,0,1,0|1,0,0]=3 108 B8R0.29 CP(=O)(C)CCC(=O)O Molport-002-131-571 [0,1,0,0,1,0|2,0,0]=4 109 B8R0.29 CP(=O)(O)CCC(=O)O Molport-002-935-998 [0,1,0,0,1,0|1,0,0]=3 110 B8R0.29 CS(=O)(=O)CCC(=O)O Molport-004-347-249 [0,1,0,0,1,0|1,0,1]=4 111 B8R0.29 O=C(O)CCP(=O)(O)O Molport-001-759-698 [0,1,0,0,1,0|1,0,0]=3 112 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O Molport-003-844-403 [0,1,0,0,0,1|2,0,0]=4 113 B10R0.98 NC(CCCC(=O)O)C(=O)O Molport-035-944-984 [0,1,0,0,0,1|1,0,0]=3 114 B10R0.98 NC(CSCC(=O)O)C(=O)O Molport-006-013-457 [0,1,0,0,0,1|1,0,0]=3 115 B10R0.98 NC(CSCC(=O)O)C(=O)O Molport-019-997-772 [0,1,0,0,0,1|1,0,0]=3 116 B10R0.98 O=C(O)CCCC(=O)C(=O)O Molport-002-489-955 [0,1,0,0,0,1|1,0,0]=3 117 B10R0.98 O=C(O)CCCC(O)C(=O)O Molport-023-333-797 [0,1,0,0,0,1|1,0,0]=3 118 B10R0.3 CCOC(=O)CCCC(=O)C Molport-001-793-384 [0,2,0,0,0,0|2,0,0]=4 119 B10R0.3 COCC(=O)NCCC(=O)O Molport-004-297-930 [0,2,0,0,0,0|2,0,0]=4 120 B10R0.57 COC(=O)[C@@H](N)CCC(=O)N Molport-002-498-099 [0,2,0,0,0,0|2,0,0]=4 121 B10R0.59 CCC(=O)CCCC(=O)OC Molport-019-922-334 [0,2,0,0,0,0|2,0,0]=4 122 B10R0.59 COC(=O)/C=C/CC(=O)OC Molport-003-935-103 [0,2,0,0,0,0|1,0,1]=4 123 B10R0.59 COC(=O)CNCC(=O)OC Molport-002-330-198 [0,2,0,0,0,0|0,0,0]=2 124 B10R0.82 COC(=O)CC[C@H](N)C(=O)O Molport-003-935-175 [0,2,0,0,0,0|1,0,0]=3 125 B10R0.82 N[C@@H](CCC(=O)NO)C(=O)O Molport-047-918-525 [0,2,0,0,0,0|1,0,0]=3 126 B10R0.13 CC(=O)C(C)C(C)CC(=O)O Molport-022-368-919 [0,2,0,0,0,0|2,0,0]=4 127 B10R0.43 CC(=O)CNC(C)(C)C(=O)C Molport-035-714-694 [0,2,0,0,0,0|2,0,0]=4 128 B10R0.84 CNC(CCC(=O)[O-])C(=O)O Molport-052-044-249 [0,2,0,0,0,0|1,0,1]=4 129 B10R0.92 NC(CCP(=O)(O)O)C(=O)O Molport-002-513-394 [0,2,0,0,0,0|2,0,0]=4 130 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O Molport-002-514-399 [0,2,0,0,0,0|2,0,0]=4 131 B10R0.92 N[C@@H](CCS(=O)(=O)O)C(=O)O Molport-003-941-750 [0,2,0,0,0,0|2,0,0]=4 132 B10R0.165 O=C(O)CC(F)(F)CC(=O)O Molport-009-037-995 [0,2,0,0,0,0|1,0,0]=3 133 B8R1.4 O=C1CCCC(=O)O1 Molport-001-793-730 [1,0,0,1,0,0|1,0,0]=3 134 B8R1.4 O=C1CNCC(=O)N1 Molport-020-168-252 [1,0,0,1,0,0|1,0,0]=3 135 B8R1.4 O=C1COCC(=O)N1 Molport-003-935-109 [1,0,0,1,0,0|2,0,0]=4 136 B8R1.4 O=C1CSCC(=O)O1 Molport-000-145-823 [1,0,0,1,0,0|1,0,0]=3 137 B8R1.7 O=C(O)C1C=CCN1 Molport-001-769-493 [1,0,0,1,0,0|1,0,0]=3 138 B8R1.7 O=C(O)C1CCCN1 Molport-027-837-861 [1,0,0,1,0,0|1,0,1]=4 139 B8R1.23 C=C1CC(C1)C(=O)O Molport-001-769-523 [0,0,0,1,1,0|2,0,0]=4 140 B8R1.23 O=C1CC(C1)C(=O)O Molport-000-876-904 [0,0,0,1,1,0|1,0,0]=3 141 B8R1.23 O=C1CC(N1)C(=O)O Molport-016-578-545 [0,0,0,1,1,0|1,0,0]=3 142 B8R1.51 O=C1CCS(=O)(=O)O1 Molport-020-168-286 [0,0,0,1,1,0|1,0,1]=4 143 B10R1.54 CC1=NN(CC1)CC(=O)O Molport-008-154-187 [0,0,0,1,0,1|2,0,0]=4 144 B10R1.54 CC1=NN(CC1)CC(=O)O Molport-019-930-967 [0,0,0,1,0,1|2,0,0]=4 145 B10R1.54 O=C(O)CC1=CC(=NN1)O Molport-022-148-213 [0,0,0,1,0,1|2,0,0]=4 146 B10R1.54 O=C(O)CN1C=NC(=N1)O Molport-035-872-232 [0,0,0,1,0,1|1,0,1]=4 147 B10R1.54 O=C(O)CN1CCC(C1)O Molport-027-835-328 [0,0,0,1,0,1|1,0,1]=4 148 B10R1.54 O=C(O)CN1N=NC(=N1)O Molport-002-718-752 [0,0,0,1,0,1|2,0,0]=4 149 B10R1.113 O=C1CC(CNN1)C(=O)O Molport-028-956-950 [0,0,0,1,0,1|2,0,0]=4 150 B10R1.113 O=C1CSCC(N1)C(=O)O Molport-000-005-135 [0,0,0,1,0,1|2,0,0]=4 151 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O Molport-029-499-611 [0,0,0,1,0,1|1,0,0]=3 152 B10R1.13 O=C(O)C1CCC(CN1)O Molport-018-618-293 [0,1,0,1,0,0|1,0,1]=4 153 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O Molport-005-942-243 [0,1,0,1,0,0|1,0,1]=4 154 B10R1.13 O=C1CCC(CC1)C(=O)O Molport-000-127-797 [0,1,0,1,0,0|2,0,0]=4 155 B10R1.13 O=C1CCC(CN1)C(=O)O Molport-004-346-573 [0,1,0,1,0,0|2,0,0]=4 156 B10R1.13 O=C1CNC(CN1)C(=O)O Molport-038-386-786 [0,1,0,1,0,0|1,0,0]=3 157 B10R1.14 COC(=O)C1CC(CN1)O Molport-004-414-815 [0,1,0,1,0,0|1,0,1]=4 158 B10R1.14 COC(=O)C1CNC(=O)O1 Molport-004-780-787 [0,1,0,1,0,0|2,0,0]=4 159 B10R1.14 COC(=O)[C@H]1CCC(=O)N1 Molport-020-394-713 [0,1,0,1,0,0|2,0,0]=4 160 B10R1.408 CNC(=O)[C@H]1C[C@@H]1C(=O)O Molport-039-054-925 [0,1,0,1,0,0|2,0,0]=4 161 B10R1.360 CC1(CC1C(=O)O)C(=O)O Molport-002-559-050 [0,1,0,1,0,0|1,0,0]=3 162 B10R1.59 CN1NC(=O)CC1C(=O)O Molport-047-633-212 [0,1,0,1,0,0|2,0,0]=4 163 B10R1.282 C=C1[C@H]([C@@H]1C(=O)O)C(=O)O Molport-002-507-022 [0,1,0,1,0,0|1,0,0]=3 164 B6R0.2 CC(=O)CC(=O)C Molport-000-871-954 [0,0,0,0,2,0|2,0,0]=4 165 B6R0.2 CC(=O)CC(=O)N Molport-003-925-054 [0,0,0,0,2,0|2,0,0]=4 166 B6R0.2 CC(=O)CC(=O)[O-] Molport-046-683-289 [0,0,0,0,2,0|1,0,1]=4 167 B6R0.2 CC(=O)NC(=O)N Molport-005-273-810 [0,0,0,0,2,0|2,0,0]=4 168 B6R0.2 NC(=O)CC(=O)N Molport-000-219-445 [0,0,0,0,2,0|2,0,0]=4 169 B6R0.2 NC(=O)NC(=O)N Molport-001-012-586 [0,0,0,0,2,0|2,0,0]=4 170 B10R0.97 NC(=O)NCCCCC(=O)O Molport-001-729-022 [0,0,0,0,0,2|2,0,0]=4 171 B10R0.97 O=C(O)CSCSCC(=O)O Molport-001-011-850 [0,0,0,0,0,2|1,0,0]=3