0 B10R0.3 CC(CCO)CCC=C(C)C Molport-001-769-687 [0,1,0,0,0,0|2,0,1]=4 1 B10R0.3 C[C@@H](CCO)CCC=C(C)C Molport-002-535-711 [0,1,0,0,0,0|2,0,1]=4 2 B10R0.3 C[C@H](CCO)CCC=C(C)C Molport-003-845-967 [0,1,0,0,0,0|2,0,1]=4 3 B10R1.10 CCOC1CCCC(=O)C1 Molport-004-802-861 [0,0,0,1,0,0|1,0,2]=4 4 B10R1.10 OCCC1CCCC(=O)C1 Molport-046-551-768 [0,0,0,1,0,0|1,0,2]=4 5 B10R1.16 CCCCC1CCC(=O)O1 Molport-001-786-937 [0,0,0,1,0,0|1,0,2]=4 6 B10R1.16 CCCCC1CNC(=O)C1 Molport-046-299-333 [0,0,0,1,0,0|1,0,1]=3 7 B10R1.16 CCCC[C@H]1CCC(=O)O1 Molport-019-989-915 [0,0,0,1,0,0|1,0,2]=4 8 B10R1.18 CC(=O)OC1CCCCC1 Molport-001-783-801 [0,0,0,1,0,0|1,0,1]=3 9 B10R1.18 NC(=O)OC1CCCCC1 Molport-001-816-002 [0,0,0,1,0,0|2,0,1]=4 10 B10R1.39 CCC1CCCC1C(=O)O Molport-022-366-777 [0,0,0,1,0,0|1,0,2]=4 11 B10R1.39 CCC1CCNC1C(=O)O Molport-044-832-101 [0,0,0,1,0,0|2,0,1]=4 12 B10R1.39 CC[C@@H]1CCN[C@H]1C(=O)N Molport-051-779-744 [0,0,0,1,0,0|2,0,1]=4 13 B10R1.39 CC[C@@H]1CCO[C@@H]1C(=O)O Molport-042-623-510 [0,0,0,1,0,0|2,0,1]=4 14 B10R1.61 CC(=O)C1CCCCC1N Molport-030-005-730 [0,0,0,1,0,0|1,0,2]=4 15 B10R1.61 CC1CCCCC1C(=O)C Molport-025-073-816 [0,0,0,1,0,0|0,0,2]=3 16 B10R1.61 CC1CCCCC1C(=O)O Molport-001-791-871 [0,0,0,1,0,0|1,0,2]=4 17 B10R1.64 CC1CCCC1CC(=O)O Molport-000-004-647 [0,0,0,1,0,0|1,0,2]=4 18 B10R1.66 CC(=O)CCC1CCCC1 Molport-012-857-868 [0,0,0,1,0,0|0,0,2]=3 19 B10R1.66 CC(=O)OCC1CCCO1 Molport-001-783-806 [0,0,0,1,0,0|2,0,1]=4 20 B10R1.66 CC(=O)OCC1CCNC1 Molport-016-575-310 [0,0,0,1,0,0|2,0,1]=4 21 B10R1.66 CC(=O)OCC1CCNC1 Molport-046-871-012 [0,0,0,1,0,0|2,0,1]=4 22 B10R1.66 OC(=O)C#CC1CCCC1 Molport-021-321-553 [0,0,0,1,0,0|1,0,2]=4 23 B10R1.162 COC1CCCCC(=O)C1 Molport-052-044-730 [0,0,0,1,0,0|1,0,2]=4 24 B10R1.348 OC(=O)C1=CCCCCC1 Molport-028-952-171 [0,0,0,1,0,0|1,0,0]=2 25 B7R0.4 CC(=CCCCN)C Molport-022-364-717 [2,0,0,0,0,0|2,0,0]=4 26 B7R0.4 CC(=CCCCO)C Molport-046-790-896 [2,0,0,0,0,0|2,0,0]=4 27 B7R0.4 CCCCC=C(C)C Molport-003-926-052 [2,0,0,0,0,0|1,0,0]=3 28 B9R0.1 CNC(C)CCC=C(C)C Molport-006-111-500 [1,1,0,0,0,0|2,0,0]=4 29 B11R0.147 CCCC[C@@H](C)CCC=C(C)C Molport-053-105-383 [0,2,0,0,0,0|1,0,1]=4 30 B9R1.5 CC1CCCCCC1=O Molport-014-212-811 [1,0,0,1,0,0|0,0,2]=4 31 B9R1.8 OCC=C1CCCCC1 Molport-006-112-671 [1,0,0,1,0,0|0,0,2]=4 32 B9R1.12 N#C/C=C/C1CCCC1 Molport-006-704-947 [1,0,0,1,0,0|1,0,1]=4 33 B9R1.12 N#CC=CC1CCCC1 Molport-013-566-641 [1,0,0,1,0,0|1,0,1]=4 34 B9R1.15 CCC1CCCCC1=O Molport-011-284-659 [1,0,0,1,0,0|0,0,2]=4 35 B9R1.15 CC[C@H]1CCCCC1=O Molport-051-570-693 [1,0,0,1,0,0|0,0,2]=4 36 B9R1.33 C/C=C/[C@@H]1CCC[C@H]1O Molport-053-105-758 [1,0,0,1,0,0|1,0,1]=4 37 B9R1.33 CCCC1CCCC1=O Molport-003-179-113 [1,0,0,1,0,0|0,0,2]=4 38 B9R1.33 CCCC1CCNC1=O Molport-033-484-472 [1,0,0,1,0,0|1,0,1]=4 39 B9R1.33 CC\1CCC/C1=C/C#N Molport-047-900-273 [1,0,0,1,0,0|1,0,1]=4 40 B9R1.89 OCC1CCC=CCC1 Molport-035-862-149 [1,0,0,1,0,0|1,0,1]=4 41 B9R1.2 CCC1CCCC(=O)C1 Molport-016-578-489 [1,0,0,1,0,0|0,0,1]=3 42 B9R1.2 CC[C@@H]1CCCC(=O)C1 Molport-047-932-231 [1,0,0,1,0,0|0,0,1]=3 43 B9R1.2 CC[C@H]1CCCC(=O)C1 Molport-047-932-232 [1,0,0,1,0,0|0,0,1]=3 44 B9R1.2 CNC1CCCC(=O)C1 Molport-051-773-384 [1,0,0,1,0,0|1,0,1]=4 45 B9R1.2 COC1CCCC(=O)C1 Molport-026-522-604 [1,0,0,1,0,0|1,0,1]=4 46 B9R1.2 CSC1CCCC(=O)C1 Molport-021-506-429 [1,0,0,1,0,0|1,0,1]=4 47 B9R1.2 FCC1CCCC(=O)C1 Molport-029-078-260 [1,0,0,1,0,0|1,0,1]=4 48 B9R1.2 OCC1CCCC(=O)C1 Molport-009-196-945 [1,0,0,1,0,0|1,0,1]=4 49 B9R1.6 CC(=C)C1CCCCC1 Molport-021-452-082 [1,0,0,1,0,0|1,0,1]=4 50 B9R1.7 CCCC1CCC(=O)C1 Molport-021-277-613 [1,0,0,1,0,0|0,0,1]=3 51 B9R1.7 CCCC1CCC(=O)O1 Molport-001-781-618 [1,0,0,1,0,0|1,0,1]=4 52 B9R1.7 CCCC1CNC(=O)C1 Molport-008-154-344 [1,0,0,1,0,0|1,0,0]=3 53 B9R1.7 CCCC1COC(=O)C1 Molport-049-219-561 [1,0,0,1,0,0|1,0,0]=3 54 B9R1.7 CCCC1COC(=O)O1 Molport-047-580-265 [1,0,0,1,0,0|2,0,0]=4 55 B9R1.7 CCC[C@@H]1COC(=O)C1 Molport-051-610-865 [1,0,0,1,0,0|1,0,0]=3 56 B9R1.7 CCC[C@H]1COC(=O)C1 Molport-044-560-837 [1,0,0,1,0,0|1,0,0]=3 57 B9R1.7 CCOC1CCC(=O)C1 Molport-025-713-970 [1,0,0,1,0,0|1,0,1]=4 58 B9R1.7 COCC1CCC(=O)C1 Molport-025-640-692 [1,0,0,1,0,0|1,0,1]=4 59 B9R1.7 NCCC1CNC(=O)C1 Molport-042-622-884 [1,0,0,1,0,0|2,0,0]=4 60 B9R1.7 OCCC1CNC(=O)C1 Molport-029-241-933 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.13 CC(=O)CC1CCOC1 Molport-023-198-065 [1,0,0,1,0,0|1,0,1]=4 62 B9R1.13 CC(=O)OC1CCCO1 Molport-006-113-464 [1,0,0,1,0,0|2,0,0]=4 63 B9R1.13 CC(=O)OC1CCNC1 Molport-016-575-311 [1,0,0,1,0,0|2,0,0]=4 64 B9R1.13 CC(=O)OC1CCOC1 Molport-052-058-090 [1,0,0,1,0,0|2,0,0]=4 65 B9R1.13 CC(=O)O[C@@H]1CCNC1 Molport-047-638-787 [1,0,0,1,0,0|2,0,0]=4 66 B9R1.13 CC(=O)O[C@H]1CCNC1 Molport-047-638-400 [1,0,0,1,0,0|2,0,0]=4 67 B9R1.13 NC(=O)OC1CCCC1 Molport-002-801-425 [1,0,0,1,0,0|2,0,0]=4 68 B9R1.41 CC1CCCC1C(=O)O Molport-006-758-086 [1,0,0,1,0,0|1,0,1]=4 69 B9R1.41 CC1OCCC1C(=O)C Molport-026-226-980 [1,0,0,1,0,0|1,0,1]=4 70 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)C Molport-051-784-097 [1,0,0,1,0,0|1,0,1]=4 71 B9R1.48 CC1CCCCC(=O)C1 Molport-021-278-709 [1,0,0,1,0,0|0,0,1]=3 72 B9R1.48 C[C@@H]1CCCCC(=O)C1 Molport-047-642-438 [1,0,0,1,0,0|0,0,1]=3 73 B11R1.157 CC(=O)OC1CCCC(C1)O Molport-052-044-666 [0,1,0,1,0,0|1,0,1]=4 74 B11R1.157 CC(C)CC1CCCC(=O)C1 Molport-021-277-500 [0,1,0,1,0,0|0,0,2]=4 75 B11R1.27 CCCCCC1CCC(=O)O1 Molport-000-856-082 [0,1,0,1,0,0|1,0,1]=4 76 B11R1.86 CC(C)/C=C/1\CCCCC1O Molport-001-921-993 [0,1,0,1,0,0|1,0,1]=4 77 B11R1.86 CC1CCCCC1OC(=O)C Molport-005-935-144 [0,1,0,1,0,0|0,0,2]=4 78 B11R1.91 CC(=CCC1CCCNC1)C Molport-032-516-844 [0,1,0,1,0,0|1,0,1]=4 79 B11R1.110 CCOC1CCCCC(=O)C1 Molport-052-044-731 [0,1,0,1,0,0|0,0,2]=4 80 B11R1.34 CCCC1CC(=O)CC(=O)C1 Molport-001-770-015 [0,1,0,1,0,0|0,0,1]=3 81 B11R1.230 CCCCC1CC(=O)OC1=O Molport-028-747-781 [0,1,0,1,0,0|1,0,0]=3 82 B11R1.20 CC1CCC(=CC(=O)O)CC1 Molport-003-915-965 [0,1,0,1,0,0|1,0,0]=3 83 B11R1.75 CC(C)CCC1CCC(=O)C1 Molport-021-277-641 [0,1,0,1,0,0|0,0,2]=4 84 B11R1.1 CCCCC1CCC(=O)CC1 Molport-023-278-578 [0,1,0,1,0,0|0,0,2]=4 85 B11R1.25 COC(=O)C#CC1CCCC1 Molport-021-321-350 [0,1,0,1,0,0|0,0,2]=4 86 B11R1.40 CCC(=O)OC1CCCCC1 Molport-003-959-991 [0,1,0,1,0,0|1,0,1]=4 87 B11R1.40 NCC(=O)OC1CCCCC1 Molport-023-137-048 [0,1,0,1,0,0|1,0,1]=4 88 B11R1.59 CC[C@@H]1CCN[C@@H]1C(=O)OC Molport-051-643-891 [0,1,0,1,0,0|1,0,1]=4 89 B11R1.59 CC[C@@H]1CCN[C@H]1C(=O)OC Molport-051-698-434 [0,1,0,1,0,0|1,0,1]=4 90 B11R1.59 CC[C@H]1CCN[C@@H]1C(=O)OC Molport-051-524-691 [0,1,0,1,0,0|1,0,1]=4 91 B11R1.59 CC[C@H]1CCN[C@H]1C(=O)OC Molport-051-643-900 [0,1,0,1,0,0|1,0,1]=4 92 B11R1.35 C/C(=C\C1CCCC1)/C(=O)O Molport-036-183-549 [0,1,0,1,0,0|1,0,0]=3 93 B11R1.35 CC(=CC1CCCC1)C(=O)O Molport-027-631-884 [0,1,0,1,0,0|1,0,0]=3 94 B11R1.36 CC(=C1CCCCC1)C(=O)O Molport-002-910-628 [0,1,0,1,0,0|1,0,0]=3 95 B11R2.35 O=C1CCCC(C1)C2CC2 Molport-020-094-339 [0,0,0,2,0,0|0,0,2]=4 96 B11R2.36 O=C1CCC2CCCC2C1 Molport-021-996-999 [0,0,0,2,0,0|0,0,2]=4 97 B11R2.36 O=C1CC[C@@H]2CCC[C@@H]2C1 Molport-051-770-970 [0,0,0,2,0,0|0,0,2]=4 98 B11R2.678 O=C1CC2CCCC(C2)C1 Molport-028-932-672 [0,0,0,2,0,0|0,0,2]=4 99 B11R2.678 O=C1CC2CCCN(C2)C1 Molport-023-314-206 [0,0,0,2,0,0|1,0,1]=4 100 B11R2.1478 O=C1CC2(CCC2)CCN1 Molport-046-736-752 [0,0,0,2,0,0|1,0,1]=4 101 B11R2.1478 O=C1CC2(CCC2)CCO1 Molport-042-621-406 [0,0,0,2,0,0|1,0,1]=4 102 B11R2.1478 O=C1CCCC2(C1)CCC2 Molport-046-590-802 [0,0,0,2,0,0|0,0,2]=4 103 B11R2.1 O=C1CCC2=C1CCCC2 Molport-051-545-909 [0,0,0,2,0,0|0,0,2]=4 104 B11R2.1 O=C1CCC2C1CCCC2 Molport-035-921-621 [0,0,0,2,0,0|0,0,2]=4 105 B11R2.1 O=C1NCC2C1CCCC2 Molport-020-007-153 [0,0,0,2,0,0|1,0,1]=4 106 B11R2.1 O=C1NC[C@H]2[C@@H]1CCCC2 Molport-006-119-584 [0,0,0,2,0,0|1,0,1]=4 107 B11R2.1 O=C1OCC2C1CCCC2 Molport-035-945-130 [0,0,0,2,0,0|1,0,1]=4 108 B11R2.1 O=C1OC[C@@H]2[C@H]1CCCC2 Molport-029-002-409 [0,0,0,2,0,0|1,0,1]=4 109 B11R2.1 O=C1OC[C@H]2[C@@H]1CCCC2 Molport-035-941-748 [0,0,0,2,0,0|1,0,1]=4 110 B11R2.10 O=C1CC2CCCCC2=C1 Molport-003-913-461 [0,0,0,2,0,0|0,0,0]=2 111 B11R2.10 O=C1CC2CCCCC2C1 Molport-022-257-396 [0,0,0,2,0,0|0,0,2]=4 112 B11R2.10 O=C1C[C@@H]2CCCC[C@@H]2N1 Molport-044-652-095 [0,0,0,2,0,0|1,0,1]=4 113 B11R2.352 O=C1CC(CN1)C2CCC2 Molport-027-633-499 [0,0,0,2,0,0|1,0,1]=4 114 B11R2.359 O=C1CC2CCC(C2)CN1 Molport-038-354-997 [0,0,0,2,0,0|1,0,1]=4 115 B11R2.748 O=C1CC2(CCCC2)CO1 Molport-037-963-927 [0,0,0,2,0,0|1,0,1]=4 116 B11R2.748 O=C1CCC2(C1)CCCC2 Molport-038-355-048 [0,0,0,2,0,0|0,0,2]=4 117 B11R2.748 O=C1CNC2(C1)CCCC2 Molport-038-087-765 [0,0,0,2,0,0|1,0,1]=4 118 B11R2.433 O=C1CC2CCC(N1)CC2 Molport-039-241-862 [0,0,0,2,0,0|1,0,1]=4 119 B11R2.433 O=C1C[C@H]2CCN(C1)CC2 Molport-039-333-937 [0,0,0,2,0,0|1,0,1]=4 120 B11R2.703 O=C1CC2(C1)CCCCC2 Molport-025-494-787 [0,0,0,2,0,0|0,0,2]=4 121 B11R2.703 O=C1CC2(N1)CCCCC2 Molport-021-452-436 [0,0,0,2,0,0|1,0,1]=4 122 B11R2.11 O=C1CC(C1)C2CCCC2 Molport-029-248-428 [0,0,0,2,0,0|0,0,2]=4 123 B11R2.711 O=C1NC2C1CCCCC2 Molport-020-966-523 [0,0,0,2,0,0|1,0,1]=4 124 B11R2.711 O=C1N[C@H]2[C@@H]1CCCCC2 Molport-038-387-557 [0,0,0,2,0,0|1,0,1]=4 125 B11R2.845 OC(=O)C1=CC2CCC1C2 Molport-022-879-029 [0,0,0,2,0,0|1,0,0]=3 126 B11R2.845 OC(=O)C1=C[C@H]2CC[C@@H]1C2 Molport-051-718-427 [0,0,0,2,0,0|1,0,0]=3 127 B11R2.813 CC(=O)C12CC1CCCC2 Molport-004-770-962 [0,0,0,2,0,0|0,0,2]=4 128 B11R2.813 CC(=O)C12CCCCC1O2 Molport-047-771-377 [0,0,0,2,0,0|1,0,1]=4