0 B9R0.39 C/C(=N/C(CS)C(=O)O)/O Molport-039-344-857 [0,0,0,0,0,0|0,0,2]=2 1 B9R0.39 CC(=O)NC(C#N)C(=O)N Molport-002-711-624 [0,0,0,0,0,0|2,0,1]=3 2 B9R0.39 CC(=O)NC(CS)C(=O)O Molport-002-042-380 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.39 CC(=O)N[C@@H](CS)C(=O)N Molport-035-941-448 [0,0,0,0,0,0|1,0,0]=1 4 B9R0.39 CCC(NC(=O)C)C(=O)O Molport-001-791-794 [0,0,0,0,0,0|1,0,0]=1 5 B9R0.39 NCC(CC(=O)O)C(=O)O Molport-027-707-309 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.15 CCCC(CC)C(=O)O Molport-006-123-148 [1,0,0,0,0,0|2,0,1]=4 7 B8R0.23 C/C(=N\C(=O)N)/C(=O)O Molport-045-901-741 [1,0,0,0,0,0|1,0,2]=4 8 B8R0.23 CC(=O)CC(N)C(=O)O Molport-023-314-128 [1,0,0,0,0,0|2,0,0]=3 9 B8R0.23 CC(=O)NC(C)C(=O)C Molport-001-781-700 [1,0,0,0,0,0|1,0,0]=2 10 B8R0.23 CC(=O)NC(C)C(=O)O Molport-001-791-849 [1,0,0,0,0,0|0,0,0]=1 11 B8R0.23 CC(CN(C)C)C(=O)O Molport-005-958-941 [1,0,0,0,0,0|3,0,0]=4 12 B8R0.23 CC(CN(C)C)C(=O)O Molport-006-066-798 [1,0,0,0,0,0|3,0,0]=4 13 B8R0.23 CC(NC(=O)N)C(=O)O Molport-001-794-441 [1,0,0,0,0,0|1,0,0]=2 14 B8R0.23 O=C(O)CC(S)C(=O)O Molport-001-763-895 [1,0,0,0,0,0|2,0,0]=3 15 B8R0.23 O=C(O)CC(S)C(=O)O Molport-051-552-437 [1,0,0,0,0,0|2,0,0]=3 16 B8R0.23 O=C([O-])CC(O)C(=O)O Molport-051-568-515 [1,0,0,0,0,0|2,1,0]=4 17 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(=O)O Molport-003-934-579 [1,0,0,0,0,0|3,0,0]=4 18 B10R0.23 CCCC(CC(=O)C)C(=O)O Molport-002-507-001 [0,1,0,0,0,0|2,0,0]=3 19 B10R0.53 NCC(=O)NC(CO)C(=O)O Molport-002-523-592 [0,1,0,0,0,0|0,1,0]=2 20 B10R0.119 CC(CN)(CC(=O)O)C(=O)O Molport-028-766-987 [0,1,0,0,0,0|3,0,0]=4 21 B10R0.162 CC(=O)NC(=C(Cl)Cl)C(=O)O Molport-003-009-856 [0,1,0,0,0,0|1,0,2]=4 22 B10R0.162 CC(=O)N[C@@H](C(=O)O)C(C)C Molport-002-507-071 [0,1,0,0,0,0|1,0,0]=2 23 B10R0.162 CC(C)C(NC(=O)N)C(=O)O Molport-002-463-930 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.64 NC(=O)NC1CCCC1=O Molport-047-116-730 [0,0,0,1,0,0|3,0,0]=4 25 B10R1.64 NC(=O)NC1CSCC1O Molport-002-748-478 [0,0,0,1,0,0|2,0,1]=4 26 B10R1.113 CC1CCCC(N1)C(=O)O Molport-016-578-936 [0,0,0,1,0,0|2,0,1]=4 27 B10R1.113 O=C1CC(CNN1)C(=O)O Molport-028-956-950 [0,0,0,1,0,0|3,0,0]=4 28 B10R1.113 O=C1CSCC(N1)C(=O)O Molport-000-005-135 [0,0,0,1,0,0|0,0,0]=1 29 B10R1.351 CC(=O)N[C@@H]1CC[C@@]1(C)O Molport-046-768-615 [0,0,0,1,0,0|2,0,1]=4 30 B10R1.359 CC1(N[C@@H](CS1)C(=O)O)C Molport-000-924-823 [0,0,0,1,0,0|1,0,1]=3 31 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O Molport-029-499-611 [0,0,0,1,0,0|3,0,0]=4 32 B7R0.5 CCOC(C)C(=O)O Molport-004-341-569 [2,0,0,0,0,0|1,0,1]=4 33 B7R0.5 CNCC(C)C(=O)O Molport-016-635-341 [2,0,0,0,0,0|2,0,0]=4 34 B7R0.15 CCC(NC)C(=O)N Molport-011-903-568 [2,0,0,0,0,0|2,0,0]=4 35 B7R0.15 CCC(NC)C(=O)O Molport-011-836-124 [2,0,0,0,0,0|1,0,0]=3 36 B7R0.15 CCC(NC)C(=O)O Molport-016-634-445 [2,0,0,0,0,0|1,0,0]=3 37 B7R0.15 CNC(CO)C(=O)O Molport-019-998-723 [2,0,0,0,0,0|0,1,0]=3 38 B7R0.15 COC(CN)C(=O)O Molport-027-844-961 [2,0,0,0,0,0|2,0,0]=4 39 B7R0.2 CC(=O)NC(C)CO Molport-008-508-252 [2,0,0,0,0,0|0,0,1]=3 40 B7R0.6 CC(=O)CCC(=O)C Molport-000-871-964 [2,0,0,0,0,0|2,0,0]=4 41 B7R0.6 CC(=O)CNC(=O)C Molport-000-005-232 [2,0,0,0,0,0|1,0,0]=3 42 B7R0.6 CC(C)NCC(=O)O Molport-002-472-582 [2,0,0,0,0,0|1,0,1]=4 43 B7R0.6 NC(=O)NCC(=O)O Molport-000-894-377 [2,0,0,0,0,0|1,0,0]=3 44 B7R0.6 O=[13C](O)CC[13C](=O)O Molport-003-934-537 [2,0,0,0,0,0|2,0,0]=4 45 B9R0.11 CC(=O)NC(C)(C)C(=O)O Molport-009-676-978 [1,1,0,0,0,0|0,0,0]=2 46 B9R0.11 C[C@@](O)(CC(=O)O)C(=O)O Molport-044-561-564 [1,1,0,0,0,0|2,0,0]=4 47 B9R0.23 C=C(NC(=O)C)C(=O)OC Molport-003-929-946 [1,1,0,0,0,0|0,0,2]=4 48 B9R0.23 COC(=O)C(C)NC(=O)C Molport-011-171-700 [1,1,0,0,0,0|0,0,0]=2 49 B9R0.42 C=C(NC(=O)CCl)C(=O)O Molport-003-001-156 [1,1,0,0,0,0|0,0,2]=4 50 B9R0.42 CCC(=O)CC(N)C(=O)O Molport-027-845-455 [1,1,0,0,0,0|2,0,0]=4 51 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O Molport-004-773-539 [1,1,0,0,0,0|0,0,0]=2 52 B9R0.42 COC(=O)CC(C)C(=O)O Molport-022-367-139 [1,1,0,0,0,0|1,0,0]=3 53 B9R0.42 COC(=O)CC(N)C(=O)O Molport-003-925-943 [1,1,0,0,0,0|2,0,0]=4 54 B9R0.57 CC(NS(=O)(=O)C)C(=O)O Molport-002-472-591 [1,1,0,0,0,0|1,0,0]=3 55 B9R0.79 CC(C(=O)O)C(O)C(=O)O Molport-001-785-695 [1,1,0,0,0,0|2,0,0]=4 56 B11R0.32 CC(=O)NC(NC(=O)C)C(Cl)Cl Molport-004-246-266 [0,1,0,0,0,1|2,0,0]=4 57 B11R0.28 CC(=O)CCC(C(=O)O)C(C)C Molport-002-506-940 [0,1,0,0,0,1|2,0,0]=4 58 B11R0.146 CCCC(CCC(=O)C)C(=O)O Molport-002-506-957 [0,1,0,0,0,1|2,0,0]=4 59 B11R0.115 CCC(C)C(NC(=O)C)C(=O)O Molport-003-917-789 [0,2,0,0,0,0|1,0,0]=3 60 B11R0.115 CCC(C)[C@H](NC(=O)C)C(=O)O Molport-002-893-877 [0,2,0,0,0,0|1,0,0]=3 61 B11R0.115 CC[C@@H](C)[C@@H](NC(=O)C)C(=O)O Molport-002-507-083 [0,2,0,0,0,0|1,0,0]=3 62 B11R0.115 CC[C@H](C)[C@H](NC(=O)C)C(=O)O Molport-001-794-411 [0,2,0,0,0,0|1,0,0]=3 63 B11R0.160 CCCCC(NC(=O)C)C(=O)O Molport-002-893-881 [0,2,0,0,0,0|1,0,0]=3 64 B11R0.160 CCCC[C@H](NC(=O)C)C(=O)O Molport-001-792-734 [0,2,0,0,0,0|1,0,0]=3 65 B11R0.160 CSCCC(NC(=O)N)C(=O)O Molport-001-991-337 [0,2,0,0,0,0|1,0,0]=3 66 B11R0.160 CSCC[C@@H](NC(=O)C)C(=O)O Molport-003-939-590 [0,2,0,0,0,0|0,0,0]=2 67 B11R0.236 CCCC(NC(=O)CN)C(=O)O Molport-002-510-206 [0,2,0,0,0,0|1,0,0]=3 68 B11R0.108 CC(C)[C@H](NC(=O)CCl)C(=O)O Molport-001-766-276 [0,2,0,0,0,0|1,0,0]=3 69 B11R0.234 CC(=O)NC(C(=O)O)C(C)(C)S Molport-003-940-074 [0,2,0,0,0,0|0,0,0]=2 70 B11R0.234 CC(=O)N[C@@H](C(=O)O)C(C)(C)S Molport-003-925-157 [0,2,0,0,0,0|0,0,0]=2 71 B11R0.234 CC(C)(C)[C@@H](NC(=O)N)C(=O)O Molport-033-430-611 [0,2,0,0,0,0|2,0,0]=4 72 B9R1.6 O=C(O)C1CNCCN1 Molport-000-141-392 [1,0,0,1,0,0|1,0,1]=4 73 B9R1.6 O=C(O)C1CNCCN1 Molport-001-768-421 [1,0,0,1,0,0|1,0,1]=4 74 B9R1.6 O=C(O)C1CSCCN1 Molport-000-006-313 [1,0,0,1,0,0|0,0,1]=3 75 B9R1.6 O=C(O)[C@@H]1CCCCN1 Molport-002-498-081 [1,0,0,1,0,0|1,0,1]=4 76 B9R1.6 O=C(O)[C@H]1CNCCN1 Molport-000-005-914 [1,0,0,1,0,0|1,0,1]=4 77 B9R1.35 NC1=NC(CS1)C(=O)O Molport-000-726-999 [1,0,0,1,0,0|1,0,1]=4 78 B9R1.35 NC1=NC(CS1)C(=O)O Molport-002-559-095 [1,0,0,1,0,0|1,0,1]=4 79 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 Molport-003-928-936 [1,0,0,1,0,0|0,1,0]=3 80 B9R1.35 O=C1CC(CN1)C(=O)O Molport-000-005-185 [1,0,0,1,0,0|2,0,0]=4 81 B9R1.35 O=C1C[C@@H](CN1)C(=O)O Molport-035-868-754 [1,0,0,1,0,0|2,0,0]=4 82 B9R1.35 O=C1NCC(O1)C(=O)O Molport-023-313-073 [1,0,0,1,0,0|2,0,0]=4 83 B9R1.35 O=C1NC[C@H](N1)C(=O)O Molport-004-963-012 [1,0,0,1,0,0|1,0,0]=3 84 B9R1.35 O=C1N[C@H](CS1)C(=O)O Molport-002-509-226 [1,0,0,1,0,0|0,0,0]=2 85 B9R1.161 O=C(O)C1CC1C(=O)O Molport-003-711-390 [1,0,0,1,0,0|2,0,0]=4 86 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O Molport-027-837-330 [1,0,0,1,0,0|2,0,0]=4 87 B9R1.168 CC(=O)C1(CC1)C(=O)O Molport-008-155-860 [0,0,0,1,1,0|1,0,0]=3 88 B9R1.168 NC(=O)C1(CC1)C(=O)O Molport-000-152-679 [0,0,0,1,1,0|2,0,0]=4 89 B9R1.168 O=C(O)C1(CC1)C(=O)O Molport-000-153-787 [0,0,0,1,1,0|2,0,0]=4 90 B11R1.74 O=C1CC(=O)CC(C1)C(=O)O Molport-001-761-200 [0,1,0,1,0,0|1,1,0]=4 91 B11R1.74 O=C1CC(NC(=O)N1)C(=O)O Molport-003-922-613 [0,1,0,1,0,0|1,1,0]=4 92 B11R1.178 CC(=O)N1CCCC1C(=O)O Molport-000-144-437 [0,1,0,1,0,0|1,0,0]=3 93 B11R1.178 CC(=O)N1CCCC1C(=O)O Molport-003-700-719 [0,1,0,1,0,0|1,0,0]=3 94 B11R1.178 CC(=O)N1CSC[C@H]1C(=O)O Molport-006-130-393 [0,1,0,1,0,0|0,0,0]=2 95 B11R1.178 NC(=O)N1CCCC1C(=O)O Molport-002-464-038 [0,1,0,1,0,0|2,0,0]=4 96 B11R1.497 O=C1CCCCC(N1)C(=O)O Molport-020-167-138 [0,1,0,1,0,0|1,0,0]=3 97 B11R1.167 CC1=NC[C@@H]([C@H](N1)C(=O)O)O Molport-052-044-062 [0,1,0,1,0,0|1,1,0]=4 98 B11R1.228 COC(=O)N[C@@H]1CSC[C@@H]1O Molport-002-749-184 [0,1,0,1,0,0|1,0,1]=4 99 B11R1.228 O=C(CCl)NC1CCSC1=O Molport-000-395-704 [0,1,0,1,0,0|1,1,0]=4 100 B11R1.584 CC(=O)NC1C(=O)SC1(C)C Molport-010-699-824 [0,1,0,1,0,0|1,1,0]=4 101 B11R2.208 O=C1CNC(=O)C2(N1)CC2 Molport-035-394-327 [0,0,0,2,0,0|2,0,0]=4 102 B7R0.16 CC(=O)C(C)C(=O)C Molport-001-787-673 [1,0,0,0,1,0|1,0,0]=3 103 B7R0.16 CC(=O)C(Cl)C(=O)C Molport-001-792-168 [1,0,0,0,1,0|2,0,0]=4 104 B7R0.16 CC(C(=O)N)C(=O)N Molport-003-661-421 [1,0,0,0,1,0|2,0,0]=4 105 B9R0.7 CC(=O)N/N=C(\C)/C(=O)O Molport-002-933-773 [1,0,0,0,0,1|0,0,1]=3 106 B9R0.7 CC(=O)SCC(C)C(=O)N Molport-035-394-812 [1,0,0,0,0,1|2,0,0]=4 107 B9R0.7 CC(=O)SCC(C)C(=O)O Molport-002-893-880 [1,0,0,0,0,1|1,0,0]=3 108 B9R0.7 CC(NCC(=O)O)C(=O)O Molport-003-355-448 [1,0,0,0,0,1|1,0,0]=3 109 B11R0.143 CC(=O)NCC(CCl)OC(=O)C Molport-002-744-024 [0,0,0,0,0,2|2,0,0]=4