0 B8R0.11 CCCCC(C=O)CC Molport-001-794-225 [1,0,0,0,0,0|0,0,2]=3 1 B8R0.11 CCCNC(CC)CC Molport-029-997-557 [1,0,0,0,0,0|2,0,0]=3 2 B8R0.11 CCN(CC)CCCN Molport-001-794-224 [1,0,0,0,0,0|3,0,0]=4 3 B8R0.11 COC(CN)CCSC Molport-027-801-681 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.9 CCC(CC)N1CCCC1 Molport-047-739-937 [0,0,0,1,0,0|3,0,0]=4 5 B10R1.19 O=C1CCCCCN1CO Molport-002-470-869 [0,0,0,1,0,0|1,0,2]=4 6 B10R1.25 CC1CCC(C(C1)C)C=O Molport-002-675-099 [0,0,0,1,0,0|1,0,2]=4 7 B10R1.25 CC1CCC(C(C1)C)CO Molport-000-701-638 [0,0,0,1,0,0|1,0,0]=2 8 B10R1.245 CC1CCCC(C1CN)C Molport-025-072-692 [0,0,0,1,0,0|2,0,0]=3 9 B10R1.478 CCC1(CCCC1=O)CC Molport-044-187-734 [0,0,0,1,0,0|1,0,2]=4 10 B10R0.34 CCN(CC)CC(O)COC Molport-002-551-143 [0,0,0,0,0,1|3,0,0]=4 11 B7R0.3 CC(CO)NCCO Molport-009-204-662 [2,0,0,0,0,0|2,0,0]=4 12 B7R0.3 CCCCC(=O)CC Molport-001-769-757 [2,0,0,0,0,0|0,0,2]=4 13 B7R0.3 CCCNC(C)CO Molport-015-081-622 [2,0,0,0,0,0|1,0,0]=3 14 B7R0.3 CCCOC(C)CN Molport-008-154-264 [2,0,0,0,0,0|2,0,0]=4 15 B7R0.3 CCN(C)CCNC Molport-013-347-915 [2,0,0,0,0,0|2,0,0]=4 16 B7R0.3 CCOCC(O)CN Molport-000-001-192 [2,0,0,0,0,0|2,0,0]=4 17 B7R0.3 CCOCC(O)CN Molport-029-657-436 [2,0,0,0,0,0|2,0,0]=4 18 B7R0.3 COCCC(N)CO Molport-020-915-935 [2,0,0,0,0,0|2,0,0]=4 19 B7R0.3 CSCCC(O)CN Molport-021-604-943 [2,0,0,0,0,0|2,0,0]=4 20 B7R0.5 CC(C)C(O)CCN Molport-008-643-583 [2,0,0,0,0,0|1,0,0]=3 21 B7R0.5 CCCC(C)C(C)N Molport-039-129-648 [2,0,0,0,0,0|2,0,0]=4 22 B7R0.7 CCCC(C)NCC Molport-029-997-553 [2,0,0,0,0,0|2,0,0]=4 23 B7R0.7 CCCC(N)CCC Molport-006-842-449 [2,0,0,0,0,0|1,0,0]=3 24 B7R0.7 CCCC(O)CCO Molport-028-747-679 [2,0,0,0,0,0|0,0,0]=2 25 B7R0.7 CCC[C@@H](O)CCO Molport-044-562-472 [2,0,0,0,0,0|0,0,0]=2 26 B7R0.7 CCC[C@H](N)CCO Molport-027-835-083 [2,0,0,0,0,0|1,0,0]=3 27 B7R0.7 CCNC(C)CCO Molport-005-958-927 [2,0,0,0,0,0|2,0,0]=4 28 B7R0.7 CNCC(O)CNC Molport-047-398-570 [2,0,0,0,0,0|2,0,0]=4 29 B7R0.7 CNCC(O)COC Molport-004-370-779 [2,0,0,0,0,0|2,0,0]=4 30 B7R0.10 CCC(=O)C(O)CC Molport-001-790-092 [2,0,0,0,0,0|0,0,2]=4 31 B7R0.10 O[C@H](CS)[C@@H](O)CS Molport-003-932-853 [2,0,0,0,0,0|2,0,0]=4 32 B7R0.12 CCNC(CC)CC Molport-019-930-976 [2,0,0,0,0,0|2,0,0]=4 33 B7R0.12 CCOC(CC)CN Molport-029-997-670 [2,0,0,0,0,0|2,0,0]=4 34 B7R0.15 CNC(CO)C(C)C Molport-012-794-540 [2,0,0,0,0,0|2,0,0]=4 35 B9R0.27 OC[C@@H](O)[C@@H](O)[13C@@H](O)CO Molport-053-110-314 [1,1,0,0,0,0|2,0,0]=4 36 B9R0.27 OC[C@@H](O)[C@@H](O)[C@@H](O)[13CH2]O Molport-051-992-653 [1,1,0,0,0,0|2,0,0]=4 37 B9R0.27 OC[C@H](O)[C@@H](O)[C@H](O)[13CH2]O Molport-053-129-573 [1,1,0,0,0,0|2,0,0]=4 38 B9R0.35 CCCC(O)C(=O)OCC Molport-003-936-979 [1,1,0,0,0,0|0,0,2]=4 39 B9R0.13 CCCCC(CC)C(=O)Cl Molport-001-791-413 [1,1,0,0,0,0|0,0,2]=4 40 B9R0.50 CCCCCC(CO)CO Molport-001-766-424 [1,1,0,0,0,0|1,0,0]=3 41 B9R0.50 CCN(CC)CCCCN Molport-002-011-650 [1,1,0,0,0,0|2,0,0]=4 42 B9R0.50 CCN(CC)CCCNC Molport-004-405-949 [1,1,0,0,0,0|2,0,0]=4 43 B11R0.72 CCOCC(O)CN(CC)CC Molport-002-548-850 [0,1,0,0,0,1|2,0,0]=4 44 B9R1.3 CC1NCC[C@@H]([C@@H]1C)O Molport-046-848-608 [1,0,0,1,0,0|1,0,0]=3 45 B9R1.5 N[C@@H]1CCCCC[C@H]1O Molport-002-054-387 [1,0,0,1,0,0|1,0,0]=3 46 B9R1.11 CCC(C)C1CCCN1 Molport-000-147-748 [1,0,0,1,0,0|1,0,0]=3 47 B9R1.15 CN1CCCCC1CO Molport-001-791-411 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.15 CNC1CCCCC1O Molport-002-020-737 [1,0,0,1,0,0|1,0,0]=3 49 B9R1.15 N#C[C@@H]1CCCC[C@H]1O Molport-002-054-047 [1,0,0,1,0,0|1,0,1]=4 50 B9R1.15 NC1CCCCC1CO Molport-044-192-486 [1,0,0,1,0,0|1,0,0]=3 51 B9R1.15 OC[C@H]1CCNC[C@@H]1O Molport-029-997-854 [1,0,0,1,0,0|1,0,0]=3 52 B9R1.15 OC[C@H]1CCNC[C@H]1O Molport-029-997-828 [1,0,0,1,0,0|1,0,0]=3 53 B9R1.15 OC[C@H]1CNCC[C@H]1O Molport-047-524-479 [1,0,0,1,0,0|1,0,0]=3 54 B9R1.69 CC1CC(C(CN1)C)O Molport-000-003-489 [1,0,0,1,0,0|1,0,0]=3 55 B9R1.69 CC1CN(CCC1O)C Molport-046-852-853 [1,0,0,1,0,0|2,0,0]=4 56 B9R1.1 C=C1CCC(CC1)CO Molport-009-194-534 [1,0,0,1,0,0|0,0,2]=4 57 B9R1.1 CC1=CCC(CC1)CO Molport-004-831-283 [1,0,0,1,0,0|0,0,2]=4 58 B9R1.1 CC1CCC(CC1)CN Molport-009-315-326 [1,0,0,1,0,0|1,0,0]=3 59 B9R1.1 CC1CCC(CC1)CN Molport-039-030-310 [1,0,0,1,0,0|1,0,0]=3 60 B9R1.1 CCC1CCC(CC1)N Molport-000-145-112 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.1 CCC1CCC(NC1)C Molport-001-768-167 [1,0,0,1,0,0|1,0,0]=3 62 B9R1.1 CCC1COC(CN1)C Molport-002-465-425 [1,0,0,1,0,0|1,0,0]=3 63 B9R1.1 CN1CCC(CC1)CBr Molport-019-931-128 [1,0,0,1,0,0|2,0,0]=4 64 B9R1.1 CN1CCC(CC1)CCl Molport-006-827-067 [1,0,0,1,0,0|2,0,0]=4 65 B9R1.1 CN1CCC(CC1)CN Molport-016-575-230 [1,0,0,1,0,0|2,0,0]=4 66 B9R1.1 CN1CCC(CC1)CO Molport-000-004-073 [1,0,0,1,0,0|1,0,0]=3 67 B9R1.1 O=C1CCC(CC1)CO Molport-001-769-566 [1,0,0,1,0,0|1,0,1]=4 68 B9R1.12 CCCCC1CCCN1 Molport-000-002-274 [1,0,0,1,0,0|2,0,0]=4 69 B9R1.12 CCCNC1CCCC1 Molport-003-179-086 [1,0,0,1,0,0|2,0,0]=4 70 B9R1.12 CCCNC1CCCC1 Molport-003-993-550 [1,0,0,1,0,0|2,0,0]=4 71 B9R1.12 NCCCC1CCCC1 Molport-004-326-827 [1,0,0,1,0,0|2,0,0]=4 72 B9R1.12 NCCCC1CCOC1 Molport-002-744-549 [1,0,0,1,0,0|1,0,0]=3 73 B9R1.21 CCN1CCC(C1)CN Molport-001-795-008 [1,0,0,1,0,0|2,0,0]=4 74 B9R1.21 CCN1CCC(C1)CO Molport-003-003-769 [1,0,0,1,0,0|1,0,0]=3 75 B9R1.89 CCC1CCCNCC1 Molport-012-665-943 [1,0,0,1,0,0|2,0,0]=4 76 B9R1.89 CNC1CCCCCC1 Molport-029-997-606 [1,0,0,1,0,0|2,0,0]=4 77 B9R1.89 OCC1CCCCCC1 Molport-003-894-602 [1,0,0,1,0,0|0,0,0]=2 78 B9R1.89 OCC1CCCCCN1 Molport-016-585-912 [1,0,0,1,0,0|1,0,0]=3 79 B9R1.89 OCC1CCCNCC1 Molport-019-870-495 [1,0,0,1,0,0|1,0,0]=3 80 B9R1.89 OCC1CCNCCO1 Molport-029-501-103 [1,0,0,1,0,0|2,0,0]=4 81 B9R1.89 OCC1CNCCOC1 Molport-029-078-269 [1,0,0,1,0,0|2,0,0]=4 82 B9R1.94 CCC1(CC1CN)CC Molport-003-178-853 [1,0,0,1,0,0|2,0,0]=4 83 B9R1.120 CC1CCC1(CO)CO Molport-046-071-744 [1,0,0,1,0,0|1,0,0]=3 84 B9R1.193 CCOCC1(CC1)CN Molport-019-930-940 [1,0,0,1,0,0|2,0,0]=4 85 B9R1.204 CCC1(CCNC1)CC Molport-008-154-361 [1,0,0,1,0,0|2,0,0]=4 86 B9R1.204 N#CC1(CCCC1)CO Molport-008-750-913 [1,0,0,1,0,0|1,0,1]=4 87 B9R1.204 NCC1(CCCC1)CO Molport-006-068-957 [1,0,0,1,0,0|1,0,0]=3 88 B11R1.12 OCC(CO)C1CCCCC1 Molport-003-713-199 [0,1,0,1,0,0|2,0,0]=4 89 B11R1.51 CCN1CCCCCC1CO Molport-002-084-334 [0,1,0,1,0,0|2,0,0]=4 90 B11R1.51 O/N=C\1/CCCCCC1NO Molport-051-494-093 [0,1,0,1,0,0|1,0,1]=4 91 B11R1.51 O/N=C\1/CCCCCC1[NH2+]O Molport-000-707-682 [0,1,0,1,0,0|1,0,1]=4 92 B11R1.18 NCCCN1CCCC1CO Molport-000-116-684 [0,1,0,1,0,0|2,0,0]=4 93 B11R1.16 CCCC(O)C1CCCCC1 Molport-002-480-747 [0,1,0,1,0,0|1,0,0]=3 94 B11R1.81 CCCC1CCC(CC1O)C Molport-002-539-800 [0,1,0,1,0,0|1,0,0]=3 95 B11R1.278 OC[C@H]1NC[C@@H]([C@H]([C@H]1O)O)O Molport-039-016-078 [0,1,0,1,0,0|2,0,0]=4 96 B11R1.278 OC[C@H]1NC[C@H]([C@H]([C@@H]1O)O)O Molport-003-941-192 [0,1,0,1,0,0|2,0,0]=4 97 B11R1.166 CC(C)[C@H]1CC[C@H](C[C@@H]1O)C Molport-001-793-331 [0,1,0,1,0,0|1,0,0]=3 98 B11R1.166 CC1CCC(C(C1)N)C(C)C Molport-002-893-263 [0,1,0,1,0,0|2,0,0]=4 99 B11R1.1047 CC1CC[C@](C(C1)C)(C)CO Molport-002-511-909 [0,1,0,1,0,0|1,0,0]=3 100 B11R2.106 OC1CCNC2C1CCC2 Molport-022-468-313 [0,0,0,2,0,0|2,0,0]=4 101 B11R2.191 NC[C@H]1CC[C@H]2[C@@H]1CCC2 Molport-046-683-144 [0,0,0,2,0,0|2,0,0]=4 102 B11R2.1098 NCC12CCCC1CCC2 Molport-046-737-043 [0,0,0,2,0,0|2,0,0]=4 103 B11R2.2 C1CCC(C1)C2CCCN2 Molport-000-147-771 [0,0,0,2,0,0|2,0,0]=4 104 B11R2.3 O=C1CCCC12CCOC2 Molport-044-187-682 [0,0,0,2,0,0|0,0,2]=4 105 B11R2.3 O[C@@H]1CCC[C@@]12CCCN2 Molport-046-554-275 [0,0,0,2,0,0|2,0,0]=4 106 B11R2.696 C[N+]12CCC(CC1)C(C2)O Molport-000-717-450 [0,0,0,2,0,0|2,0,0]=4 107 B11R2.696 C[N+]12CCC(CC1)C(C2)O Molport-009-766-550 [0,0,0,2,0,0|2,0,0]=4