0 B9R0.55 CC(=O)CCCOC(=O)C Molport-001-790-649 [0,0,0,0,0,0|3,0,0]=3 1 B9R0.55 CC(=O)NCCNC(=O)C Molport-000-496-270 [0,0,0,0,0,0|4,0,0]=4 2 B9R0.55 NC(=O)CCCCC(=O)N Molport-000-872-078 [0,0,0,0,0,0|2,0,0]=2 3 B9R0.55 NC(=O)NCCCC(=O)O Molport-000-713-206 [0,0,0,0,0,0|2,0,0]=2 4 B8R0.7 C/C=C/CCCC(=O)O Molport-022-365-475 [1,0,0,0,0,0|1,0,1]=3 5 B8R0.7 CC(=O)CCCOC=O Molport-002-704-977 [1,0,0,0,0,0|2,0,0]=3 6 B8R0.7 CC(=O)NCCCCO Molport-008-508-803 [1,0,0,0,0,0|2,0,1]=4 7 B8R0.7 CCCCCCC(=O)O Molport-001-780-041 [1,0,0,0,0,0|1,0,1]=3 8 B8R0.7 CCCNCCC(=O)O Molport-002-472-204 [1,0,0,0,0,0|2,0,1]=4 9 B8R0.7 CCCNCCC(=O)O Molport-019-922-357 [1,0,0,0,0,0|2,0,1]=4 10 B8R0.7 COCCOCC(=O)O Molport-001-791-765 [1,0,0,0,0,0|3,0,0]=4 11 B8R0.7 COCCOCC(=O)O Molport-053-122-888 [1,0,0,0,0,0|3,0,0]=4 12 B8R0.7 N#CCCNCC(=O)O Molport-001-793-057 [1,0,0,0,0,0|2,0,1]=4 13 B8R0.7 NCCCCCC(=O)N Molport-028-912-861 [1,0,0,0,0,0|2,0,1]=4 14 B8R0.7 NOCCCCC(=O)O Molport-052-006-562 [1,0,0,0,0,0|2,0,0]=3 15 B8R0.7 O=C(Cl)CCCCCCl Molport-003-936-496 [1,0,0,0,0,0|2,0,1]=4 16 B8R0.7 O=C(O)CCCCCBr Molport-000-900-562 [1,0,0,0,0,0|1,0,1]=3 17 B8R0.7 O=C(O)CCOCCS Molport-047-918-915 [1,0,0,0,0,0|1,1,1]=4 18 B8R0.7 O=C([O-])CCCCCCl Molport-047-739-952 [1,0,0,0,0,0|1,0,2]=4 19 B10R0.15 CS(=O)(=O)NCCCC(=O)O Molport-002-472-558 [0,1,0,0,0,0|2,0,1]=4 20 B10R0.15 [2H]C([2H])([2H])CCCCC(=O)O Molport-003-934-816 [0,1,0,0,0,0|2,0,1]=4 21 B10R0.55 COC(=O)CSCCC(=S)N Molport-001-764-301 [0,1,0,0,0,0|2,1,0]=4 22 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O Molport-003-844-403 [0,1,0,0,0,0|2,0,0]=3 23 B10R0.98 CC(C)CCC[C@H](N)C(=O)O Molport-023-332-999 [0,1,0,0,0,0|2,0,1]=4 24 B10R0.98 NC(CCCC(=O)O)C(=O)O Molport-035-944-984 [0,1,0,0,0,0|0,0,0]=1 25 B10R0.98 NC(CSCC(=O)O)C(=O)O Molport-006-013-457 [0,1,0,0,0,0|1,0,0]=2 26 B10R0.98 NC(CSCC(=O)O)C(=O)O Molport-019-997-772 [0,1,0,0,0,0|1,0,0]=2 27 B10R0.98 O=C(O)CCCC(=O)C(=O)O Molport-002-489-955 [0,1,0,0,0,0|0,0,1]=2 28 B10R0.98 O=C(O)CCCC(O)C(=O)O Molport-023-333-797 [0,1,0,0,0,0|0,0,0]=1 29 B10R1.54 CC1=NN(CC1)CC(=O)O Molport-008-154-187 [0,0,0,1,0,0|3,0,0]=4 30 B10R1.54 CC1=NN(CC1)CC(=O)O Molport-019-930-967 [0,0,0,1,0,0|3,0,0]=4 31 B10R1.54 O=C(O)CN1CCC(C1)O Molport-027-835-328 [0,0,0,1,0,0|2,0,1]=4 32 B10R1.113 CC1CCCC(C1)C(=O)O Molport-001-791-799 [0,0,0,1,0,0|2,0,1]=4 33 B10R1.113 CC1CCCC(N1)C(=O)O Molport-016-578-936 [0,0,0,1,0,0|2,0,1]=4 34 B10R1.113 CN1CCCC(C1)C(=O)O Molport-001-769-338 [0,0,0,1,0,0|3,0,0]=4 35 B10R1.113 NC1CCCC(C1)C(=O)O Molport-000-150-999 [0,0,0,1,0,0|2,0,1]=4 36 B10R1.113 O=C1CC(CNN1)C(=O)O Molport-028-956-950 [0,0,0,1,0,0|3,0,0]=4 37 B10R1.113 O=C1CSCC(N1)C(=O)O Molport-000-005-135 [0,0,0,1,0,0|2,0,0]=3 38 B10R1.128 O=C(O)C1CCCC1(F)F Molport-021-997-651 [0,0,0,1,0,0|2,0,1]=4 39 B10R1.352 O=C(O)CCC1CC1(F)F Molport-042-600-135 [0,0,0,1,0,0|2,0,1]=4 40 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O Molport-029-499-611 [0,0,0,1,0,0|0,0,0]=1 41 B8R0.28 CN(C)CCCC(=O)O Molport-001-792-192 [0,0,0,0,1,0|3,0,0]=4 42 B8R0.28 CN(C)CCCC(=O)O Molport-003-928-817 [0,0,0,0,1,0|3,0,0]=4 43 B8R0.28 N=C(N)SCCC(=O)O Molport-001-786-569 [0,0,0,0,1,0|3,0,0]=4 44 B8R0.28 NC(=O)CCCC(=O)N Molport-028-749-554 [0,0,0,0,1,0|2,0,0]=3 45 B8R0.28 O=C(O)COCC(=O)O Molport-003-926-440 [0,0,0,0,1,0|1,0,0]=2 46 B8R0.28 O=C(O)CSCC(=O)O Molport-001-757-123 [0,0,0,0,1,0|1,0,0]=2 47 B10R0.97 CN(C)CCCCCC(=O)O Molport-021-073-625 [0,0,0,0,0,1|3,0,0]=4 48 B10R0.97 CN(C)CCCCCC(=O)O Molport-046-163-493 [0,0,0,0,0,1|3,0,0]=4 49 B10R0.97 N=C(N)NCCCCC(=O)O Molport-023-292-388 [0,0,0,0,0,1|2,0,0]=3 50 B10R0.97 N=C(N)SCCCCC(=O)O Molport-003-054-798 [0,0,0,0,0,1|2,0,0]=3 51 B10R0.97 NC(=O)CCSCCC(=O)N Molport-001-764-479 [0,0,0,0,0,1|2,0,0]=3 52 B10R0.97 NC(=O)NCCCCC(=O)O Molport-001-729-022 [0,0,0,0,0,1|1,0,0]=2 53 B10R0.97 NC(=[NH2+])SCCCCC(=O)O Molport-000-642-823 [0,0,0,0,0,1|2,0,0]=3 54 B10R0.97 O=C(O)CSCSCC(=O)O Molport-001-011-850 [0,0,0,0,0,1|1,0,0]=2 55 B7R0.1 O=CNCCNC=O Molport-002-710-063 [2,0,0,0,0,0|2,0,0]=4 56 B7R0.4 C=CCSCC(=O)O Molport-000-150-911 [2,0,0,0,0,0|1,0,1]=4 57 B7R0.4 CC(=O)NCCCO Molport-001-765-309 [2,0,0,0,0,0|2,0,0]=4 58 B7R0.4 CC(=O)OCCCO Molport-037-900-517 [2,0,0,0,0,0|2,0,0]=4 59 B7R0.4 CCCCCC(=O)C Molport-001-759-309 [2,0,0,0,0,0|1,0,1]=4 60 B7R0.4 CCCOCC(=O)O Molport-009-200-571 [2,0,0,0,0,0|1,0,1]=4 61 B7R0.4 CNCCCC(=O)O Molport-003-928-816 [2,0,0,0,0,0|1,0,1]=4 62 B7R0.4 CSCCCC(=O)O Molport-011-008-648 [2,0,0,0,0,0|1,0,1]=4 63 B7R0.4 N#CCCCC(=O)O Molport-020-180-062 [2,0,0,0,0,0|1,0,1]=4 64 B7R0.4 NCCCCC(=O)O Molport-003-666-360 [2,0,0,0,0,0|1,0,0]=3 65 B7R0.4 NCCSCC(=O)O Molport-023-137-056 [2,0,0,0,0,0|2,0,0]=4 66 B7R0.4 NOCCCC(=O)O Molport-027-844-893 [2,0,0,0,0,0|2,0,0]=4 67 B7R0.4 O=C(O)C#CCCO Molport-038-344-934 [2,0,0,0,0,0|0,0,2]=4 68 B7R0.4 O=C(O)CCCCS Molport-013-659-967 [2,0,0,0,0,0|0,1,0]=3 69 B9R0.2 CCCCSCCC(=O)O Molport-001-758-776 [1,1,0,0,0,0|1,0,1]=4 70 B9R0.2 CNCCCCCC(=O)O Molport-044-559-563 [1,1,0,0,0,0|1,0,1]=4 71 B9R0.2 N#CCCNCCC(=O)O Molport-008-731-541 [1,1,0,0,0,0|1,0,1]=4 72 B9R0.2 NC(=O)CCNCCCO Molport-006-702-816 [1,1,0,0,0,0|1,0,1]=4 73 B9R0.2 O=C(O)CCCCCCF Molport-029-701-977 [1,1,0,0,0,0|1,0,1]=4 74 B9R0.4 CCCCC(N)CC(=O)O Molport-002-054-093 [1,1,0,0,0,0|1,0,1]=4 75 B9R0.46 COC(=O)CCCCCN Molport-002-323-166 [1,1,0,0,0,0|1,0,1]=4 76 B9R0.47 C=CCSC[C@@H](N)C(=O)O Molport-003-666-562 [1,1,0,0,0,0|2,0,0]=4 77 B9R0.47 NC(CCCC[NH3+])C(=O)O Molport-051-608-280 [1,1,0,0,0,0|1,0,1]=4 78 B9R0.47 NCCCCC(N)C(=O)O Molport-004-963-510 [1,1,0,0,0,0|1,0,1]=4 79 B9R0.47 NCCCC[C@@H](N)C(=O)O Molport-003-937-842 [1,1,0,0,0,0|1,0,1]=4 80 B9R0.47 N[C@@H](CCCNO)C(=O)O Molport-042-668-512 [1,1,0,0,0,0|1,0,0]=3 81 B9R0.48 CCCC(N)CCC(=O)O Molport-046-681-925 [1,1,0,0,0,0|1,0,1]=4 82 B9R0.7 CC(=O)C(C)CCC(=O)O Molport-002-131-365 [0,1,0,0,1,0|1,0,0]=3 83 B9R0.7 CC(=O)C(C)CCC(=O)[O-] Molport-051-541-961 [0,1,0,0,1,0|1,0,1]=4 84 B9R0.7 CC(=O)SCC(C)C(=O)O Molport-002-893-880 [0,1,0,0,1,0|2,0,0]=4 85 B9R0.7 CC(NCC(=O)O)C(=O)O Molport-003-355-448 [0,1,0,0,1,0|1,0,0]=3 86 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Molport-046-925-996 [0,1,0,0,1,0|2,0,0]=4 87 B9R0.7 NC(=O)CC[C@H]([15NH2])C(=O)O Molport-003-934-621 [0,1,0,0,1,0|1,0,0]=3 88 B9R0.7 NC(CCC(=O)O)C(=O)O Molport-002-130-089 [0,1,0,0,1,0|0,0,0]=2 89 B9R0.7 N[C@@H](CCC(=O)O)C(O)O Molport-047-739-939 [0,1,0,0,1,0|0,0,2]=4 90 B9R0.7 N[C@@H](CCC(=O)[15NH2])C(=O)O Molport-003-934-620 [0,1,0,0,1,0|1,0,0]=3 91 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O Molport-001-795-061 [0,1,0,0,1,0|0,0,1]=3 92 B9R0.7 O=C(O)CCC(=O)C(=O)O Molport-002-322-422 [0,1,0,0,1,0|0,0,1]=3 93 B9R0.7 O=C(O)CCC(=O)C(=O)O Molport-003-941-878 [0,1,0,0,1,0|0,0,1]=3 94 B9R0.7 O=C(O)CC[C@H](O)C(=O)O Molport-046-683-545 [0,1,0,0,1,0|0,0,0]=2 95 B9R0.7 O=C([O-])CCC(O)C(=O)[O-] Molport-051-786-212 [0,1,0,0,1,0|0,0,2]=4 96 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(=O)O Molport-042-682-386 [0,1,0,0,1,0|1,0,0]=3 97 B9R0.53 NN(CC(=O)O)CC(=O)O Molport-001-789-075 [0,1,0,0,1,0|1,0,0]=3 98 B9R0.56 CS(=O)(=O)CCCC(=O)O Molport-011-192-190 [0,1,0,0,1,0|1,0,1]=4 99 B11R0.6 CC(=CCCC(C)CC(=O)O)C Molport-001-792-025 [0,1,0,0,0,1|2,0,0]=4 100 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O Molport-003-983-778 [0,1,0,0,0,1|2,0,0]=4 101 B11R0.29 CC(=O)NCSC[C@H](N)C(=O)O Molport-003-925-051 [0,1,0,0,0,1|2,0,0]=4 102 B11R0.29 NC(=[NH2+])NCCCC(N)C(=O)O Molport-051-608-281 [0,1,0,0,0,1|2,0,0]=4 103 B11R0.29 NC(CSCCB(O)O)C(=O)O Molport-046-702-125 [0,1,0,0,0,1|1,0,1]=4 104 B11R0.29 N[C@@H](CSCCB(O)O)C(=O)O Molport-042-665-860 [0,1,0,0,0,1|1,0,1]=4 105 B11R0.29 N[C@@H](CSCCC(=O)O)C(=O)O Molport-006-115-870 [0,1,0,0,0,1|0,0,0]=2 106 B11R0.85 NC(=O)CCS(=O)CCC(=O)N Molport-002-131-910 [0,1,0,0,0,1|2,0,0]=4 107 B11R0.85 O=C(O)CCS(=O)CCC(=O)O Molport-001-986-750 [0,1,0,0,0,1|0,0,0]=2 108 B11R0.318 N[C@H](CCCP(=O)(O)O)C(=O)O Molport-003-940-304 [0,2,0,0,0,0|1,0,0]=3 109 B11R0.106 COC(=O)NCCNC(=O)OC Molport-019-109-128 [0,2,0,0,0,0|2,0,0]=4 110 B11R0.106 NNC(=O)CCCCC(=O)NN Molport-000-146-044 [0,2,0,0,0,0|2,0,0]=4 111 B11R0.109 N=C(NO)NCC[C@H](N)C(=O)O Molport-039-139-149 [0,2,0,0,0,0|2,0,0]=4 112 B11R0.176 C/C=C/C(=O)NCCCC(=O)O Molport-019-332-539 [0,2,0,0,0,0|2,0,0]=4 113 B11R0.176 CCOC(=O)NCCCC(=O)O Molport-004-320-580 [0,2,0,0,0,0|1,0,0]=3 114 B11R0.150 N[C@@H](CNC(=O)C(=O)O)C(=O)O Molport-027-947-860 [0,2,0,0,0,0|1,0,1]=4 115 B9R1.6 O=C(O)C1CCCOC1 Molport-005-306-561 [1,0,0,1,0,0|2,0,0]=4 116 B9R1.6 O=C(O)C1CNCCO1 Molport-000-004-696 [1,0,0,1,0,0|1,0,1]=4 117 B9R1.6 O=C(O)[C@@H]1CCCCN1 Molport-002-498-081 [1,0,0,1,0,0|1,0,1]=4 118 B9R1.6 O=C(O)[C@@H]1CCCNC1 Molport-001-770-212 [1,0,0,1,0,0|2,0,0]=4 119 B9R1.7 CCCC1CCC(=O)O1 Molport-001-781-618 [1,0,0,1,0,0|1,0,1]=4 120 B9R1.13 O=C(O)CC1CCCC1 Molport-001-769-833 [1,0,0,1,0,0|1,0,1]=4 121 B9R1.13 O=C(O)CC1CCCO1 Molport-001-782-213 [1,0,0,1,0,0|0,0,1]=3 122 B9R1.13 O=C(O)CC1CCNC1 Molport-001-729-044 [1,0,0,1,0,0|2,0,0]=4 123 B9R1.13 O=C(O)CC1OCCO1 Molport-028-951-481 [1,0,0,1,0,0|1,0,1]=4 124 B9R1.41 CC(=O)C1CCCC1=O Molport-001-790-293 [1,0,0,1,0,0|1,0,0]=3 125 B9R1.41 NC(=O)C1CSCC1=O Molport-000-731-308 [1,0,0,1,0,0|2,0,0]=4 126 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Molport-004-778-402 [1,0,0,1,0,0|1,0,1]=4 127 B9R1.35 O=C1CC(CN1)C(=O)O Molport-000-005-185 [0,0,0,1,1,0|2,0,0]=4 128 B9R1.35 O=C1C[C@@H](CN1)C(=O)O Molport-035-868-754 [0,0,0,1,1,0|2,0,0]=4 129 B9R1.35 O=C1NCC(O1)C(=O)O Molport-023-313-073 [0,0,0,1,1,0|1,0,0]=3 130 B9R1.35 O=C1NC[C@H](N1)C(=O)O Molport-004-963-012 [0,0,0,1,1,0|2,0,0]=4 131 B9R1.35 O=C1N[C@H](CS1)C(=O)O Molport-002-509-226 [0,0,0,1,1,0|2,0,0]=4 132 B9R1.53 O=C(O)CC1CC(=O)C1 Molport-039-070-762 [0,0,0,1,1,0|1,0,0]=3 133 B9R1.161 O=C(O)C1CC1C(=O)O Molport-003-711-390 [0,0,0,1,1,0|0,0,0]=2 134 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O Molport-027-837-330 [0,0,0,1,1,0|0,0,0]=2 135 B11R1.75 O=C(O)CCC1CCC(=O)N1 Molport-002-518-794 [0,0,0,1,0,1|1,0,0]=3 136 B11R1.75 O=C(O)CSC1CCC(=O)N1 Molport-002-871-725 [0,0,0,1,0,1|1,0,0]=3 137 B11R1.157 O=C(O)CN1CCNC(=O)C1 Molport-000-148-445 [0,0,0,1,0,1|2,0,0]=4 138 B11R1.157 O=C(O)CN1CCOC(=O)C1 Molport-001-758-401 [0,0,0,1,0,1|2,0,0]=4 139 B11R1.178 CC(=O)N1CCCC1C(=O)O Molport-000-144-437 [0,0,0,1,0,1|1,0,0]=3 140 B11R1.178 CC(=O)N1CCCC1C(=O)O Molport-003-700-719 [0,0,0,1,0,1|1,0,0]=3 141 B11R1.178 CC(=O)N1CSC[C@H]1C(=O)O Molport-006-130-393 [0,0,0,1,0,1|2,0,0]=4 142 B11R1.178 NC(=O)C1CCCC1C(=O)N Molport-003-003-660 [0,0,0,1,0,1|2,0,0]=4 143 B11R1.178 NC(=O)N1CCCC1C(=O)O Molport-002-464-038 [0,0,0,1,0,1|1,0,0]=3 144 B11R1.178 O=C(O)C1=C(CCC1)C(=O)O Molport-003-922-264 [0,0,0,1,0,1|0,0,1]=3 145 B11R1.178 O=C(O)C1CCCC1C(=O)O Molport-002-894-340 [0,0,0,1,0,1|0,0,0]=2 146 B11R1.178 O=C(O)C1CCNC1C(=O)O Molport-035-944-413 [0,0,0,1,0,1|0,0,0]=2 147 B11R1.497 O=C1CCCCC(N1)C(=O)O Molport-020-167-138 [0,0,0,1,0,1|1,0,0]=3 148 B11R1.710 O=C(O)CC1CCS(=O)(=O)C1 Molport-000-392-498 [0,1,0,1,0,0|1,0,1]=4 149 B11R1.730 O=C(O)C1CCCS(=O)(=O)C1 Molport-016-631-432 [0,1,0,1,0,0|1,0,1]=4 150 B11R1.20 O=C(O)CC1CCC(=O)CC1 Molport-016-583-154 [0,1,0,1,0,0|1,0,0]=3 151 B11R1.23 COC(=O)C1=CC(=O)CCC1 Molport-028-748-704 [0,1,0,1,0,0|1,0,1]=4 152 B11R1.565 O=C1CCC(CCN1)C(=O)O Molport-022-258-765 [0,1,0,1,0,0|2,0,0]=4 153 B11R1.74 O=C1CC(=O)CC(C1)C(=O)O Molport-001-761-200 [0,1,0,1,0,0|1,0,1]=4 154 B11R1.21 N[C@H]1CC[C@H](C[C@@H]1O)C(=O)O Molport-047-526-215 [0,1,0,1,0,0|1,0,1]=4 155 B11R1.175 NC(=O)C1CCC(C1)C(=O)N Molport-035-945-914 [0,1,0,1,0,0|2,0,0]=4 156 B11R1.175 O=C(O)C1CCC(C1)C(=O)O Molport-000-480-274 [0,1,0,1,0,0|0,0,0]=2 157 B11R1.175 O=C(O)[C@H]1CC[C@H](C1)C(=O)O Molport-023-213-308 [0,1,0,1,0,0|0,0,0]=2 158 B11R2.139 O=C1CC2CC(=O)CC2C1 Molport-019-922-712 [0,0,0,2,0,0|2,0,0]=4 159 B7R0.6 CC(=O)CCC(=O)C Molport-000-871-964 [0,0,0,0,2,0|2,0,0]=4 160 B7R0.6 NC(=O)CCC(=O)N Molport-000-656-261 [0,0,0,0,2,0|2,0,0]=4 161 B7R0.6 NC(=O)NCC(=O)O Molport-000-894-377 [0,0,0,0,2,0|2,0,0]=4 162 B7R0.6 O=C(O)C#CC(=O)O Molport-001-779-893 [0,0,0,0,2,0|0,0,2]=4 163 B7R0.6 O=C([O-])[13CH2][13CH2]C(=O)[O-] Molport-051-992-875 [0,0,0,0,2,0|0,0,2]=4 164 B7R0.6 O=[13C](O)CC[13C](=O)O Molport-003-934-537 [0,0,0,0,2,0|0,0,0]=2 165 B11R0.30 CC(=O)NCCCCNC(=O)C Molport-019-107-672 [0,0,0,0,0,2|2,0,0]=4