0 B7R1.19 CC(=O)C1(CO1)C Molport-009-013-632 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.19 CC1(CO1)C(=O)O Molport-022-878-817 [0,0,0,0,0,0|2,0,0]=2 2 B6R1.7 CC1(CO1)C=C Molport-001-790-247 [1,0,0,0,0,0|3,0,0]=4 3 B6R1.7 CC1(CO1)CO Molport-003-891-783 [1,0,0,0,0,0|2,0,1]=4 4 B6R1.7 C[C@@]1(CO1)CO Molport-038-387-762 [1,0,0,0,0,0|2,0,1]=4 5 B6R1.7 C[C@]1(CO1)C=C Molport-051-570-885 [1,0,0,0,0,0|3,0,0]=4 6 B6R1.7 C[C@]1(CO1)CO Molport-046-686-601 [1,0,0,0,0,0|2,0,1]=4 7 B6R1.11 CC(=C)C1CO1 Molport-028-746-896 [1,0,0,0,0,0|3,0,0]=4 8 B6R1.11 CC(=O)C1CO1 Molport-001-756-793 [1,0,0,0,0,0|2,0,0]=3 9 B6R1.11 CC(O)C1CO1 Molport-022-878-793 [1,0,0,0,0,0|2,0,1]=4 10 B6R1.11 OC(=O)C1CO1 Molport-005-942-312 [1,0,0,0,0,0|1,0,0]=2 11 B6R1.11 OC(=O)[C@H]1CO1 Molport-021-784-630 [1,0,0,0,0,0|1,0,0]=2 12 B6R1.11 [O-]C(=O)C1CO1 Molport-021-784-625 [1,0,0,0,0,0|1,0,1]=3 13 B6R1.11 [O-]C(=O)[C@@H]1CO1 Molport-023-332-203 [1,0,0,0,0,0|1,0,1]=3 14 B6R1.11 [O-]C(=O)[C@H]1CO1 Molport-023-332-202 [1,0,0,0,0,0|1,0,1]=3 15 B8R1.39 COC(=O)C1(CO1)C Molport-001-780-098 [0,1,0,0,0,0|2,0,0]=3 16 B6R0.7 OC(=O)C(F)(F)F Molport-030-086-396 [0,0,1,0,0,0|3,0,0]=4 17 B6R0.7 OC(=O)C(F)(F)F Molport-039-240-774 [0,0,1,0,0,0|3,0,0]=4 18 B6R0.7 OC(=O)C(F)(F)F Molport-047-741-634 [0,0,1,0,0,0|3,0,0]=4 19 B8R2.19 O=C1CCC12CC2 Molport-042-650-400 [0,0,0,1,0,0|2,0,0]=3 20 B8R2.19 OC1CCC12CC2 Molport-042-650-401 [0,0,0,1,0,0|2,0,1]=4 21 B8R2.66 [O-]C(=O)C12CC1C2 Molport-051-718-666 [0,0,0,1,0,0|1,0,1]=3 22 B5R1.3 C=CC1CO1 Molport-001-787-245 [2,0,0,0,0,0|2,0,0]=4 23 B5R1.3 C=C[C@@H]1CO1 Molport-003-925-596 [2,0,0,0,0,0|2,0,0]=4 24 B5R1.3 C=C[C@H]1CO1 Molport-003-927-480 [2,0,0,0,0,0|2,0,0]=4 25 B5R1.3 OCC1CO1 Molport-001-767-787 [2,0,0,0,0,0|1,0,1]=4 26 B5R1.3 OC[C@@H]1CO1 Molport-001-793-655 [2,0,0,0,0,0|1,0,1]=4 27 B5R1.3 OC[C@H]1CO1 Molport-001-793-656 [2,0,0,0,0,0|1,0,1]=4 28 B7R1.22 COC(=O)C1CO1 Molport-009-678-711 [1,1,0,0,0,0|1,0,0]=3 29 B7R1.22 COC(=O)[C@@H]1CO1 Molport-003-933-969 [1,1,0,0,0,0|1,0,0]=3 30 B7R1.22 COC(=O)[C@H]1CO1 Molport-003-933-967 [1,1,0,0,0,0|1,0,0]=3 31 B9R1.152 CN1CC(C1)(C)C(=O)O Molport-044-615-168 [0,1,0,0,0,1|1,0,0]=3 32 B9R1.74 CCOC(=O)C1(CO1)C Molport-028-949-966 [0,2,0,0,0,0|2,0,0]=4 33 B7R1.4 CC1CCCC1=O Molport-001-793-641 [0,0,1,1,0,0|2,0,0]=4 34 B7R1.4 CC1CCNC1=O Molport-006-114-492 [0,0,1,1,0,0|2,0,0]=4 35 B7R1.4 CC1CCOC1=O Molport-003-926-035 [0,0,1,1,0,0|1,0,0]=3 36 B7R1.4 CC1OCCC1N Molport-004-802-150 [0,0,1,1,0,0|1,0,1]=4 37 B7R1.4 CC1OCCC1N Molport-044-650-620 [0,0,1,1,0,0|1,0,1]=4 38 B7R1.4 C[C@@H]1CCNC1=O Molport-035-682-382 [0,0,1,1,0,0|2,0,0]=4 39 B7R1.4 C[C@H]1CCNC1=O Molport-035-682-385 [0,0,1,1,0,0|2,0,0]=4 40 B7R1.4 C[C@H]1OCC[C@@H]1N Molport-051-761-637 [0,0,1,1,0,0|1,0,1]=4 41 B7R1.4 C[C@H]1OCC[C@H]1N Molport-038-949-807 [0,0,1,1,0,0|1,0,1]=4 42 B7R1.4 C[C@H]1OCC[C@H]1N Molport-038-949-808 [0,0,1,1,0,0|1,0,1]=4 43 B7R1.4 NC1CCCC1=O Molport-030-004-546 [0,0,1,1,0,0|1,0,0]=3 44 B7R1.4 NC1CCCC1O Molport-005-933-807 [0,0,1,1,0,0|1,0,1]=4 45 B7R1.4 NC1CCCC1O Molport-016-634-733 [0,0,1,1,0,0|1,0,1]=4 46 B7R1.4 NC1CCNC1=O Molport-006-013-052 [0,0,1,1,0,0|1,0,0]=3 47 B7R1.4 NC1CCNC1=O Molport-006-703-014 [0,0,1,1,0,0|1,0,0]=3 48 B7R1.4 NC1CCOC1=O Molport-001-768-821 [0,0,1,1,0,0|0,0,0]=2 49 B7R1.4 NC1CCOC1=O Molport-001-787-398 [0,0,1,1,0,0|0,0,0]=2 50 B7R1.4 NC1CCOC1=O Molport-019-989-908 [0,0,1,1,0,0|0,0,0]=2 51 B7R1.4 N[C@@H]1CCC[C@@H]1O Molport-002-054-132 [0,0,1,1,0,0|1,0,1]=4 52 B7R1.4 N[C@@H]1CCC[C@@H]1O Molport-004-802-164 [0,0,1,1,0,0|1,0,1]=4 53 B7R1.4 N[C@@H]1CCC[C@H]1O Molport-002-054-133 [0,0,1,1,0,0|1,0,1]=4 54 B7R1.4 N[C@@H]1CCC[C@H]1O Molport-004-802-177 [0,0,1,1,0,0|1,0,1]=4 55 B7R1.4 N[C@@H]1CCNC1=O Molport-004-802-108 [0,0,1,1,0,0|1,0,0]=3 56 B7R1.4 N[C@@H]1CCNC1=O Molport-023-334-029 [0,0,1,1,0,0|1,0,0]=3 57 B7R1.4 N[C@@H]1CCOC1=O Molport-001-793-077 [0,0,1,1,0,0|0,0,0]=2 58 B7R1.4 N[C@@H]1CCOC1=O Molport-003-933-737 [0,0,1,1,0,0|0,0,0]=2 59 B7R1.4 N[C@@H]1CCOC1=O Molport-047-593-259 [0,0,1,1,0,0|0,0,0]=2 60 B7R1.4 N[C@@H]1CCOC1=O Molport-051-697-755 [0,0,1,1,0,0|0,0,0]=2 61 B7R1.4 N[C@H]1CCC[C@@H]1O Molport-001-793-086 [0,0,1,1,0,0|1,0,1]=4 62 B7R1.4 N[C@H]1CCC[C@@H]1O Molport-003-925-541 [0,0,1,1,0,0|1,0,1]=4 63 B7R1.4 N[C@H]1CCC[C@@H]1O Molport-044-811-549 [0,0,1,1,0,0|1,0,1]=4 64 B7R1.4 N[C@H]1CCC[C@@H]1O Molport-046-588-668 [0,0,1,1,0,0|1,0,1]=4 65 B7R1.4 N[C@H]1CCC[C@H]1O Molport-004-802-153 [0,0,1,1,0,0|1,0,1]=4 66 B7R1.4 N[C@H]1CCC[C@H]1O Molport-009-197-929 [0,0,1,1,0,0|1,0,1]=4 67 B7R1.4 N[C@H]1CCC[C@H]1O Molport-051-924-785 [0,0,1,1,0,0|1,0,1]=4 68 B7R1.4 N[C@H]1CCNC1=O Molport-020-014-697 [0,0,1,1,0,0|1,0,0]=3 69 B7R1.4 N[C@H]1CCNC1=O Molport-027-835-345 [0,0,1,1,0,0|1,0,0]=3 70 B7R1.4 N[C@H]1CCOC1=O Molport-000-882-259 [0,0,1,1,0,0|0,0,0]=2 71 B7R1.4 N[C@H]1CCOC1=O Molport-003-925-555 [0,0,1,1,0,0|0,0,0]=2 72 B7R1.4 O=C1CCOC1=O Molport-051-739-326 [0,0,1,1,0,0|1,0,1]=4 73 B7R1.4 OC1CCCC1=O Molport-022-878-815 [0,0,1,1,0,0|2,0,0]=4 74 B7R1.4 OC1CCNC1=O Molport-006-701-049 [0,0,1,1,0,0|2,0,0]=4 75 B7R1.4 OC1CCOC1=O Molport-001-791-380 [0,0,1,1,0,0|1,0,0]=3 76 B7R1.4 O[C@@H]1CCNC1=O Molport-009-199-892 [0,0,1,1,0,0|2,0,0]=4 77 B7R1.4 O[C@@H]1CCOC1=O Molport-001-794-344 [0,0,1,1,0,0|1,0,0]=3 78 B7R1.4 O[C@H]1CCNC1=O Molport-002-499-339 [0,0,1,1,0,0|2,0,0]=4 79 B7R1.4 O[C@H]1CCOC1=O Molport-001-794-343 [0,0,1,1,0,0|1,0,0]=3 80 B7R2.16 C1CC12CCN2 Molport-049-224-421 [1,0,0,1,0,0|1,0,1]=4 81 B7R2.1 C1CC1C2CO2 Molport-027-605-152 [1,0,0,1,0,0|1,0,1]=4 82 B9R2.139 O=C1CC2(CC2)CN1 Molport-029-939-574 [0,0,0,1,0,1|2,0,0]=4 83 B9R2.139 O=C1CC2(CC2)CO1 Molport-037-962-167 [0,0,0,1,0,1|1,0,0]=3 84 B9R2.139 O=C1CCC2(C1)CC2 Molport-047-412-869 [0,0,0,1,0,1|2,0,0]=4 85 B9R2.139 O=C1CCC2(N1)CC2 Molport-008-154-333 [0,0,0,1,0,1|2,0,0]=4 86 B9R2.139 O=C1NC2(CC2)CO1 Molport-029-001-133 [0,0,0,1,0,1|1,0,0]=3 87 B9R2.139 O=C1NCC2(O1)CC2 Molport-029-095-216 [0,0,0,1,0,1|2,0,0]=4 88 B9R2.143 CC(=O)C1CC12CC2 Molport-004-769-556 [0,0,0,1,0,1|2,0,0]=4 89 B9R2.143 NC(=O)C1CC12CC2 Molport-051-996-367 [0,0,0,1,0,1|2,0,0]=4 90 B9R2.143 OC(=O)C1CC12CC2 Molport-000-929-112 [0,0,0,1,0,1|1,0,0]=3 91 B9R2.143 OC(=O)[C@@H]1CC12CC2 Molport-051-545-461 [0,0,0,1,0,1|1,0,0]=3 92 B9R2.143 OC(=O)[C@H]1CC12CC2 Molport-051-586-656 [0,0,0,1,0,1|1,0,0]=3 93 B9R2.30 CC12CC(C1)NC2=O Molport-037-962-145 [0,0,0,1,0,1|2,0,0]=4 94 B9R2.140 O=C1CCC12CCC2 Molport-004-968-923 [0,0,0,1,0,1|2,0,0]=4 95 B9R2.140 O=C1CCC12CNC2 Molport-047-544-255 [0,0,0,1,0,1|2,0,0]=4 96 B9R2.140 O=C1CCC12COC2 Molport-035-774-996 [0,0,0,1,0,1|2,0,0]=4 97 B9R2.140 O=C1COC12CCC2 Molport-044-182-280 [0,0,0,1,0,1|2,0,0]=4 98 B9R2.140 O=C1NCC12CCC2 Molport-044-182-348 [0,0,0,1,0,1|2,0,0]=4 99 B9R2.144 OC(=O)C12CC1CC2 Molport-044-432-434 [0,0,0,1,0,1|1,0,0]=3 100 B9R2.5 O=C1CCCC12CC2 Molport-022-909-244 [0,1,0,1,0,0|2,0,0]=4 101 B9R2.5 O=C1CCOC12CC2 Molport-052-044-041 [0,1,0,1,0,0|2,0,0]=4 102 B9R2.5 O=C1NCCC12CC2 Molport-028-753-603 [0,1,0,1,0,0|2,0,0]=4 103 B9R2.5 O=C1OCCC12CC2 Molport-028-950-678 [0,1,0,1,0,0|1,0,0]=3 104 B9R2.5 O=C1OCCC12CO2 Molport-046-147-075 [0,1,0,1,0,0|2,0,0]=4 105 B9R2.5 OC1CCNC12CC2 Molport-029-078-759 [0,1,0,1,0,0|1,0,1]=4 106 B9R2.5 OC1CNCC12CC2 Molport-028-950-819 [0,1,0,1,0,0|1,0,1]=4 107 B9R2.5 OC1CNCC12CC2 Molport-028-951-190 [0,1,0,1,0,0|1,0,1]=4 108 B9R2.5 O[C@@H]1CNCC12CC2 Molport-049-216-259 [0,1,0,1,0,0|1,0,1]=4 109 B9R2.5 O[C@@H]1CNCC12CC2 Molport-051-761-902 [0,1,0,1,0,0|1,0,1]=4 110 B9R2.5 O[C@H]1CNCC12CC2 Molport-049-231-929 [0,1,0,1,0,0|1,0,1]=4 111 B9R2.5 O[C@H]1CNCC12CC2 Molport-051-698-961 [0,1,0,1,0,0|1,0,1]=4 112 B7R1.20 OC(=O)CC1CO1 Molport-046-857-911 [1,0,0,0,0,1|1,0,0]=3 113 B9R1.163 CC(=O)C1(CCCC1)C Molport-001-790-251 [0,0,0,0,0,2|2,0,0]=4 114 B9R1.163 CC(=O)C1(CCCC1)N Molport-035-716-321 [0,0,0,0,0,2|1,0,0]=3 115 B9R1.163 CC(=O)C1(CCCC1)O Molport-009-684-915 [0,0,0,0,0,2|2,0,0]=4 116 B9R1.163 CC(=O)C1(CCCO1)C Molport-026-241-616 [0,0,0,0,0,2|2,0,0]=4 117 B9R1.163 CC(=O)C1(CCOC1)O Molport-046-870-376 [0,0,0,0,0,2|2,0,0]=4 118 B9R1.163 CC1(CCCC1)C(=O)N Molport-003-905-766 [0,0,0,0,0,2|2,0,0]=4 119 B9R1.163 CC1(CCCC1)C(=O)O Molport-002-471-326 [0,0,0,0,0,2|1,0,0]=3 120 B9R1.163 CC1(CCCN1)C(=O)N Molport-020-263-836 [0,0,0,0,0,2|2,0,0]=4 121 B9R1.163 CC1(CCCN1)C(=O)O Molport-016-631-460 [0,0,0,0,0,2|1,0,0]=3 122 B9R1.163 CC1(CCCN1)C(=O)O Molport-020-004-209 [0,0,0,0,0,2|1,0,0]=3 123 B9R1.163 CC1(CCCN1)C(=O)O Molport-023-313-650 [0,0,0,0,0,2|1,0,0]=3 124 B9R1.163 CC1(CCCO1)C(=O)O Molport-002-679-053 [0,0,0,0,0,2|1,0,0]=3 125 B9R1.163 CC1(CCNC1)C(=O)N Molport-014-686-222 [0,0,0,0,0,2|2,0,0]=4 126 B9R1.163 CC1(CCNC1)C(=O)O Molport-000-004-626 [0,0,0,0,0,2|1,0,0]=3 127 B9R1.163 CC1(CCNC1)C(=O)O Molport-023-141-392 [0,0,0,0,0,2|1,0,0]=3 128 B9R1.163 CC1(CCOC1)C(=O)O Molport-013-430-577 [0,0,0,0,0,2|1,0,0]=3 129 B9R1.163 CC1(OCCO1)C(=O)O Molport-015-142-689 [0,0,0,0,0,2|1,0,0]=3 130 B9R1.163 C[C@@]1(CCCN1)C(=O)O Molport-001-770-206 [0,0,0,0,0,2|1,0,0]=3 131 B9R1.163 C[C@@]1(CCCN1)C(=O)O Molport-028-960-121 [0,0,0,0,0,2|1,0,0]=3 132 B9R1.163 C[C@@]1(CCCO1)C(=O)O Molport-046-860-025 [0,0,0,0,0,2|1,0,0]=3 133 B9R1.163 C[C@@]1(CCNC1)C(=O)O Molport-046-837-008 [0,0,0,0,0,2|1,0,0]=3 134 B9R1.163 C[C@@]1(CCOC1)C(=O)O Molport-046-160-902 [0,0,0,0,0,2|1,0,0]=3 135 B9R1.163 C[C@]1(CCCN1)C(=O)N Molport-035-776-089 [0,0,0,0,0,2|2,0,0]=4 136 B9R1.163 C[C@]1(CCCN1)C(=O)N Molport-046-148-125 [0,0,0,0,0,2|2,0,0]=4 137 B9R1.163 C[C@]1(CCCN1)C(=O)O Molport-003-927-103 [0,0,0,0,0,2|1,0,0]=3 138 B9R1.163 C[C@]1(CCCN1)C(=O)O Molport-030-085-577 [0,0,0,0,0,2|1,0,0]=3 139 B9R1.163 C[C@]1(CCCO1)C(=O)O Molport-046-860-017 [0,0,0,0,0,2|1,0,0]=3 140 B9R1.163 C[C@]1(CCC[NH2+]1)C(=O)[O-] Molport-051-903-761 [0,0,0,0,0,2|1,0,1]=4 141 B9R1.163 C[C@]1(CCNC1)C(=O)O Molport-046-940-025 [0,0,0,0,0,2|1,0,0]=3 142 B9R1.163 NC(=O)C1(CCCC1)O Molport-012-675-614 [0,0,0,0,0,2|2,0,0]=4 143 B9R1.163 NC(=O)C1(CCNC1)O Molport-029-923-379 [0,0,0,0,0,2|2,0,0]=4 144 B9R1.163 NC1(CCCC1)C(=O)O Molport-000-000-295 [0,0,0,0,0,2|0,0,0]=2 145 B9R1.163 NC1(CCNC1)C(=O)O Molport-000-001-235 [0,0,0,0,0,2|0,0,0]=2 146 B9R1.163 NC1(CCNC1)C(=O)O Molport-044-768-344 [0,0,0,0,0,2|0,0,0]=2 147 B9R1.163 NC1(CCOC1)C(=O)O Molport-003-983-104 [0,0,0,0,0,2|0,0,0]=2 148 B9R1.163 NC1(CCOC1)C(=O)O Molport-046-195-182 [0,0,0,0,0,2|0,0,0]=2 149 B9R1.163 N[C@@]1(CCNC1)C(=O)O Molport-004-786-043 [0,0,0,0,0,2|0,0,0]=2 150 B9R1.163 N[C@@]1(CCOC1)C(=O)O Molport-046-837-093 [0,0,0,0,0,2|0,0,0]=2 151 B9R1.163 N[C@]1(CCNC1)C(=O)O Molport-004-754-654 [0,0,0,0,0,2|0,0,0]=2 152 B9R1.163 N[C@]1(CCOC1)C(=O)O Molport-039-336-579 [0,0,0,0,0,2|0,0,0]=2 153 B9R1.163 OC(=O)C1(CCCC1)O Molport-000-004-338 [0,0,0,0,0,2|1,0,0]=3 154 B9R1.163 OC(=O)C1(CCNC1)F Molport-029-217-498 [0,0,0,0,0,2|1,0,0]=3 155 B9R1.163 OC(=O)C1(CCNC1)F Molport-044-730-080 [0,0,0,0,0,2|1,0,0]=3 156 B9R1.163 OC(=O)C1(CCNC1)O Molport-033-484-223 [0,0,0,0,0,2|1,0,0]=3 157 B9R1.163 OC(=O)C1(CCNC1)O Molport-038-934-761 [0,0,0,0,0,2|1,0,0]=3 158 B9R1.163 OC(=O)C1(CCOC1)O Molport-011-133-311 [0,0,0,0,0,2|1,0,0]=3 159 B9R1.163 OC(=O)[C@@]1(CCNC1)F Molport-047-977-501 [0,0,0,0,0,2|1,0,0]=3