0 B6R1.2 BrC1=CSC=N1 Molport-000-001-745 [0,0,0,0,0,0|2,0,2]=4 1 B6R1.2 BrC1=CSN=C1 Molport-002-745-255 [0,0,0,0,0,0|2,0,2]=4 2 B6R1.2 BrC1CCCC1 Molport-000-153-781 [0,0,0,0,0,0|2,0,1]=3 3 B6R1.2 CC1=CSC=C1 Molport-019-877-432 [0,0,0,0,0,0|1,0,3]=4 4 B6R1.2 CC1=CSC=N1 Molport-000-157-534 [0,0,0,0,0,0|2,0,2]=4 5 B6R1.2 CC1=NCCN1 Molport-000-525-634 [0,0,0,0,0,0|4,0,0]=4 6 B6R1.2 CC1=NNCC1 Molport-006-309-940 [0,0,0,0,0,0|3,0,0]=3 7 B6R1.2 CC1CCSC1 Molport-009-681-074 [0,0,0,0,0,0|1,0,1]=2 8 B6R1.2 C[C@H]1CCCN1 Molport-002-501-417 [0,0,0,0,0,0|3,0,1]=4 9 B6R1.2 ClC1=NSN=C1 Molport-016-730-352 [0,0,0,0,0,0|3,0,1]=4 10 B6R1.2 ClC1CCCC1 Molport-001-759-290 [0,0,0,0,0,0|2,0,1]=3 11 B6R1.2 FC1CCNC1 Molport-016-637-620 [0,0,0,0,0,0|2,0,1]=3 12 B6R1.2 FC1CNOC1 Molport-051-547-803 [0,0,0,0,0,0|2,1,1]=4 13 B6R1.2 IC1=CSN=C1 Molport-004-968-888 [0,0,0,0,0,0|2,0,2]=4 14 B6R1.2 N=C1CCCN1 Molport-005-310-923 [0,0,0,0,0,0|3,0,0]=3 15 B6R1.2 NC1=CSN=N1 Molport-030-005-415 [0,0,0,0,0,0|3,0,1]=4 16 B6R1.2 NC1=NCCC1 Molport-004-968-713 [0,0,0,0,0,0|3,0,0]=3 17 B6R1.2 NC1=NCCS1 Molport-001-607-034 [0,0,0,0,0,0|4,0,0]=4 18 B6R1.2 NC1=NCCS1 Molport-001-767-657 [0,0,0,0,0,0|4,0,0]=4 19 B6R1.2 NC1CCCC1 Molport-000-871-509 [0,0,0,0,0,0|2,0,1]=3 20 B6R1.2 NC1CCNC1 Molport-002-343-989 [0,0,0,0,0,0|2,0,1]=3 21 B6R1.2 NC1CCOC1 Molport-001-794-861 [0,0,0,0,0,0|1,1,1]=3 22 B6R1.2 NC1CCSC1 Molport-004-305-541 [0,0,0,0,0,0|1,0,1]=2 23 B6R1.2 NC1CSSC1 Molport-002-320-000 [0,0,0,0,0,0|2,0,1]=3 24 B6R1.2 N[C@H]1CCOC1 Molport-005-937-196 [0,0,0,0,0,0|1,1,1]=3 25 B6R1.2 O=C1C=CSN1 Molport-003-986-161 [0,0,0,0,0,0|1,0,2]=3 26 B6R1.2 O=C1CCCC1 Molport-000-871-991 [0,0,0,0,0,0|1,0,0]=1 27 B6R1.2 O=C1CCCN1 Molport-003-928-391 [0,0,0,0,0,0|2,0,0]=2 28 B6R1.2 O=C1CCNC1 Molport-000-006-145 [0,0,0,0,0,0|1,0,0]=1 29 B6R1.2 O=C1CCNN1 Molport-000-141-469 [0,0,0,0,0,0|2,0,0]=2 30 B6R1.2 O=C1CCON1 Molport-027-837-068 [0,0,0,0,0,0|1,1,0]=2 31 B6R1.2 O=C1NC=NN1 Molport-001-002-006 [0,0,0,0,0,0|3,0,1]=4 32 B6R1.2 O=C1NCCS1 Molport-002-465-761 [0,0,0,0,0,0|3,0,0]=3 33 B6R1.2 O=C1NN=NN1 Molport-036-379-907 [0,0,0,0,0,0|4,0,0]=4 34 B6R1.2 O=C1OCCO1 Molport-003-925-305 [0,0,0,0,0,0|3,0,0]=3 35 B6R1.2 O=P1OCCO1 Molport-003-910-644 [0,0,0,0,0,0|4,0,0]=4 36 B6R1.2 OC1=NNCC1 Molport-006-067-044 [0,0,0,0,0,0|2,0,1]=3 37 B6R1.2 OC1=NSC=C1 Molport-006-710-373 [0,0,0,0,0,0|1,0,3]=4 38 B6R1.2 OC1=NSN=C1 Molport-002-465-325 [0,0,0,0,0,0|2,0,2]=4 39 B6R1.2 OC1CCCC1 Molport-001-759-288 [0,0,0,0,0,0|1,0,2]=3 40 B6R1.2 OC1CCNC1 Molport-000-156-385 [0,0,0,0,0,0|1,0,2]=3 41 B6R1.2 OC1CCOC1 Molport-000-156-389 [0,0,0,0,0,0|0,1,2]=3 42 B6R1.2 O[C@@H]1CCNC1 Molport-001-768-758 [0,0,0,0,0,0|1,0,2]=3 43 B6R1.2 O[C@@H]1CCSC1 Molport-035-770-278 [0,0,0,0,0,0|0,0,2]=2 44 B6R1.2 O[C@@H]1CNOC1 Molport-028-959-616 [0,0,0,0,0,0|1,1,2]=4 45 B6R1.2 O[C@H]1CCNC1 Molport-000-004-312 [0,0,0,0,0,0|1,0,2]=3 46 B6R1.2 O[C@H]1CNOC1 Molport-028-959-980 [0,0,0,0,0,0|1,1,2]=4 47 B6R1.2 S=C1NCCO1 Molport-001-766-543 [0,0,0,0,0,0|3,1,0]=4 48 B6R1.2 SC1=NCCN1 Molport-002-345-241 [0,0,0,0,0,0|3,1,0]=4 49 B6R1.2 SC1=NCCS1 Molport-000-872-192 [0,0,0,0,0,0|3,1,0]=4 50 B5R1.1 C1=CCCC1 Molport-001-759-289 [1,0,0,0,0,0|1,0,1]=3 51 B5R1.1 C1=CSC=C1 Molport-000-165-813 [1,0,0,0,0,0|0,0,3]=4 52 B5R1.1 C1=CSN=C1 Molport-002-744-213 [1,0,0,0,0,0|1,0,2]=4 53 B5R1.1 C1CCCC1 Molport-001-789-854 [1,0,0,0,0,0|1,0,1]=3 54 B5R1.1 C1CCSC1 Molport-000-158-587 [1,0,0,0,0,0|0,0,1]=2 55 B7R1.1 BrCC1CCCC1 Molport-006-709-634 [0,1,0,0,0,0|2,0,1]=4 56 B7R1.1 C=CC1CCNC1 Molport-035-385-684 [0,1,0,0,0,0|2,0,1]=4 57 B7R1.1 CNC1CCOC1 Molport-009-198-044 [0,1,0,0,0,0|1,1,1]=4 58 B7R1.1 CNC1CCSC1 Molport-035-702-374 [0,1,0,0,0,0|1,0,1]=3 59 B7R1.1 CNC1CCSC1 Molport-046-069-764 [0,1,0,0,0,0|1,0,1]=3 60 B7R1.1 CNC1CSSC1 Molport-002-320-001 [0,1,0,0,0,0|2,0,1]=4 61 B7R1.1 CN[C@H]1CCSC1 Molport-053-096-137 [0,1,0,0,0,0|1,0,1]=3 62 B7R1.1 COC1=NCCC1 Molport-000-156-994 [0,1,0,0,0,0|2,0,1]=4 63 B7R1.1 COC1CCCC1 Molport-009-767-822 [0,1,0,0,0,0|1,0,2]=4 64 B7R1.1 CSC1CCNC1 Molport-013-582-323 [0,1,0,0,0,0|1,1,1]=4 65 B7R1.1 N#CC1CCNC1 Molport-000-006-171 [0,1,0,0,0,0|2,0,1]=4 66 B7R1.1 NCC1CCCC1 Molport-003-732-830 [0,1,0,0,0,0|2,0,1]=4 67 B7R1.1 NNC1CCCC1 Molport-001-769-270 [0,1,0,0,0,0|2,0,1]=4 68 B7R1.1 NNC1CCSC1 Molport-004-321-340 [0,1,0,0,0,0|1,0,1]=3 69 B7R1.1 NOC1CCCC1 Molport-008-506-590 [0,1,0,0,0,0|1,0,2]=4 70 B7R1.1 O=CC1=CSC=C1 Molport-000-998-525 [0,1,0,0,0,0|0,0,3]=4 71 B7R1.1 O=CC1=CSC=N1 Molport-000-139-392 [0,1,0,0,0,0|1,0,2]=4 72 B7R1.1 O=CC1=CSN=N1 Molport-000-146-528 [0,1,0,0,0,0|2,0,1]=4 73 B7R1.1 O=CC1CCOC1 Molport-001-794-100 [0,1,0,0,0,0|0,1,1]=3 74 B7R1.1 O=CN1CCCC1 Molport-002-501-742 [0,1,0,0,0,0|2,0,0]=3 75 B7R1.1 OCC1CCNC1 Molport-000-006-170 [0,1,0,0,0,0|1,0,2]=4 76 B7R1.2 CC1=NNC(=O)C1 Molport-001-766-520 [0,1,0,0,0,0|2,0,1]=4 77 B7R1.2 CC1CNC(=O)O1 Molport-020-173-108 [0,1,0,0,0,0|3,0,0]=4 78 B7R1.2 CC1COC(=O)O1 Molport-003-929-830 [0,1,0,0,0,0|3,0,0]=4 79 B7R1.2 C[C@@H]1CNC(=O)C1 Molport-027-948-657 [0,1,0,0,0,0|2,0,0]=3 80 B7R1.2 C[C@@H]1COC(=O)O1 Molport-001-758-105 [0,1,0,0,0,0|3,0,0]=4 81 B7R1.2 C[C@H]1CNC(=O)O1 Molport-047-786-354 [0,1,0,0,0,0|3,0,0]=4 82 B7R1.2 N=C1CSC(=N1)N Molport-003-908-840 [0,1,0,0,0,0|2,0,1]=4 83 B7R1.2 N=C1CSC(=O)N1 Molport-000-378-322 [0,1,0,0,0,0|2,0,1]=4 84 B7R1.2 N=C1NC(=O)CS1 Molport-000-669-104 [0,1,0,0,0,0|1,0,1]=3 85 B7R1.2 N=C1NC(=O)SS1 Molport-004-947-158 [0,1,0,0,0,0|2,0,1]=4 86 B7R1.2 NC1=CC(=O)CC1 Molport-008-320-383 [0,1,0,0,0,0|1,0,1]=3 87 B7R1.2 NC1=NC(=O)CS1 Molport-000-469-366 [0,1,0,0,0,0|1,0,1]=3 88 B7R1.2 NC1=NNC(=O)C1 Molport-001-580-478 [0,1,0,0,0,0|2,0,1]=4 89 B7R1.2 NC1CNC(=O)C1 Molport-021-874-657 [0,1,0,0,0,0|2,0,0]=3 90 B7R1.2 NC1NC(=O)CS1 Molport-002-791-596 [0,1,0,0,0,0|1,0,0]=2 91 B7R1.2 N[C@@H]1CC[C@@H](C1)O Molport-023-333-453 [0,1,0,0,0,0|1,0,2]=4 92 B7R1.2 N[C@H]1CC[C@H](C1)N Molport-027-949-096 [0,1,0,0,0,0|2,0,1]=4 93 B7R1.2 N[C@H]1CC[C@H](C1)O Molport-009-684-879 [0,1,0,0,0,0|1,0,2]=4 94 B7R1.2 N[C@H]1CNC(=O)C1 Molport-039-330-473 [0,1,0,0,0,0|2,0,0]=3 95 B7R1.2 O=C1C=C(CC1)Cl Molport-008-317-255 [0,1,0,0,0,0|1,0,1]=3 96 B7R1.2 O=C1C=C(CO1)O Molport-000-145-961 [0,1,0,0,0,0|2,0,1]=4 97 B7R1.2 O=C1C=C(SN1)Cl Molport-004-895-296 [0,1,0,0,0,0|1,0,2]=4 98 B7R1.2 O=C1CC(=CO1)O Molport-016-579-189 [0,1,0,0,0,0|2,0,1]=4 99 B7R1.2 O=C1CC(CN1)O Molport-019-904-308 [0,1,0,0,0,0|2,0,0]=3 100 B7R1.2 O=C1CCC(=O)[15NH]1 Molport-003-934-915 [0,1,0,0,0,0|2,0,0]=3 101 B7R1.2 O=C1CCC(O1)O Molport-035-944-376 [0,1,0,0,0,0|2,0,0]=3 102 B7R1.2 O=C1CNC(=O)O1 Molport-000-005-136 [0,1,0,0,0,0|2,0,1]=4 103 B7R1.2 O=C1CNC(=S)S1 Molport-000-727-700 [0,1,0,0,0,0|2,0,1]=4 104 B7R1.2 O=C1C[C@@H](CO1)O Molport-001-793-714 [0,1,0,0,0,0|2,0,0]=3 105 B7R1.2 O=C1NC(=S)CS1 Molport-000-436-630 [0,1,0,0,0,0|1,1,1]=4 106 B7R1.4 CN1CCCC1=O Molport-002-317-275 [0,1,0,0,0,0|2,0,0]=3 107 B7R1.4 NC1CCCC1O Molport-016-634-733 [0,1,0,0,0,0|1,0,2]=4 108 B7R1.4 NC1CCNC1=O Molport-006-013-052 [0,1,0,0,0,0|2,0,0]=3 109 B7R1.4 NC1CCOC1=O Molport-001-787-398 [0,1,0,0,0,0|2,0,0]=3 110 B7R1.4 NC1CCOC1=O Molport-019-989-908 [0,1,0,0,0,0|2,0,0]=3 111 B7R1.4 NC1CON=C1O Molport-039-344-795 [0,1,0,0,0,0|1,1,1]=4 112 B7R1.4 NC1CSCC1O Molport-002-164-888 [0,1,0,0,0,0|0,0,2]=3 113 B7R1.4 NN1CCCC1=O Molport-006-757-999 [0,1,0,0,0,0|2,0,0]=3 114 B7R1.4 NN1CCOC1=O Molport-001-760-482 [0,1,0,0,0,0|3,0,0]=4 115 B7R1.4 N[C@@H]1CCC[C@H]1F Molport-044-811-531 [0,1,0,0,0,0|2,0,1]=4 116 B7R1.4 N[C@@H]1CCC[C@H]1O Molport-004-802-177 [0,1,0,0,0,0|1,0,2]=4 117 B7R1.4 N[C@@H]1CCNC1=O Molport-004-802-108 [0,1,0,0,0,0|2,0,0]=3 118 B7R1.4 N[C@@H]1COC[C@H]1F Molport-046-768-668 [0,1,0,0,0,0|1,1,1]=4 119 B7R1.4 N[C@@H]1COC[C@H]1O Molport-004-802-243 [0,1,0,0,0,0|0,1,2]=4 120 B7R1.4 N[C@@H]1CSC[C@@H]1O Molport-009-757-699 [0,1,0,0,0,0|0,0,2]=3 121 B7R1.4 N[C@@H]1CSC[C@H]1O Molport-009-757-770 [0,1,0,0,0,0|0,0,2]=3 122 B7R1.4 O=C1CCCC1=O Molport-029-944-668 [0,1,0,0,0,0|1,0,1]=3 123 B7R1.4 O=C1NCCC1Br Molport-019-878-539 [0,1,0,0,0,0|2,0,0]=3 124 B7R1.4 O=C1NCCC1O Molport-006-701-049 [0,1,0,0,0,0|2,0,0]=3 125 B7R1.4 O=C1NCC[C@@H]1O Molport-002-499-339 [0,1,0,0,0,0|2,0,0]=3 126 B7R1.4 O=C1OCCC1Br Molport-001-768-893 [0,1,0,0,0,0|2,0,0]=3 127 B7R1.4 OC1CNCC1O Molport-030-005-526 [0,1,0,0,0,0|1,0,2]=4 128 B7R1.4 OC1COCC1O Molport-046-067-668 [0,1,0,0,0,0|0,1,2]=4 129 B7R1.4 O[C@H]1COC[C@H]1O Molport-003-930-575 [0,1,0,0,0,0|0,1,2]=4 130 B7R1.14 CC1(CCNC1)C Molport-006-703-025 [0,1,0,0,0,0|2,0,1]=4 131 B7R1.14 N=S1(=O)CCCC1 Molport-029-996-241 [0,1,0,0,0,0|2,0,0]=3 132 B7R1.14 O=S1(=O)C=CCC1 Molport-000-392-348 [0,1,0,0,0,0|2,0,1]=4 133 B7R1.14 O=S1(=O)CC=CC1 Molport-000-392-347 [0,1,0,0,0,0|2,0,1]=4 134 B7R1.14 O=S1(=O)CCCC1 Molport-000-392-376 [0,1,0,0,0,0|2,0,0]=3 135 B5R0.1 C/C=C/C(=O)C Molport-001-786-612 [0,0,1,0,0,0|1,0,1]=3 136 B5R0.1 C/C=C/C(=O)Cl Molport-001-793-407 [0,0,1,0,0,0|2,0,1]=4 137 B5R0.1 C=C(C)CCO Molport-003-926-226 [0,0,1,0,0,0|1,1,0]=3 138 B5R0.1 C=C(C)CNN Molport-000-871-560 [0,0,1,0,0,0|3,0,0]=4 139 B5R0.1 C=COC(=O)C Molport-001-781-486 [0,0,1,0,0,0|2,0,1]=4 140 B5R0.1 CC(=CCBr)C Molport-001-791-956 [0,0,1,0,0,0|2,0,1]=4 141 B5R0.1 CC(=O)CC#N Molport-016-637-915 [0,0,1,0,0,0|1,0,1]=3 142 B5R0.1 CC(=O)CCN Molport-016-899-706 [0,0,1,0,0,0|1,0,0]=2 143 B5R0.1 CC(C)CCBr Molport-000-875-341 [0,0,1,0,0,0|2,0,1]=4 144 B5R0.1 CC(C)CCCl Molport-001-783-738 [0,0,1,0,0,0|2,0,1]=4 145 B5R0.1 CC(C)CCI Molport-001-770-162 [0,0,1,0,0,0|2,0,1]=4 146 B5R0.1 CC(C)CCN Molport-003-927-223 [0,0,1,0,0,0|2,0,1]=4 147 B5R0.1 CC(C)CCO Molport-001-793-103 [0,0,1,0,0,0|1,1,1]=4 148 B5R0.1 CC(O)CCO Molport-003-927-418 [0,0,1,0,0,0|0,1,2]=4 149 B5R0.1 CCCC(=O)C Molport-001-783-786 [0,0,1,0,0,0|1,0,0]=2 150 B5R0.1 CCCC(=O)Cl Molport-000-871-699 [0,0,1,0,0,0|2,0,0]=3 151 B5R0.1 CCCC(=O)O Molport-001-769-669 [0,0,1,0,0,0|2,0,0]=3 152 B5R0.1 CCC[C@H](C)N Molport-039-014-155 [0,0,1,0,0,0|2,0,1]=4 153 B5R0.1 CCC[N+](=O)[O-] Molport-003-938-817 [0,0,1,0,0,0|3,0,0]=4 154 B5R0.1 CCNC(=O)N Molport-001-790-642 [0,0,1,0,0,0|3,0,0]=4 155 B5R0.1 CCOC(=N)C Molport-003-925-073 [0,0,1,0,0,0|3,0,0]=4 156 B5R0.1 CCOC(=O)Cl Molport-000-872-022 [0,0,1,0,0,0|3,0,0]=4 157 B5R0.1 CN(C)CCN Molport-001-769-719 [0,0,1,0,0,0|3,0,0]=4 158 B5R0.1 CNCC(=O)N Molport-001-791-882 [0,0,1,0,0,0|2,0,0]=3 159 B5R0.1 CNCC(=O)N Molport-009-765-559 [0,0,1,0,0,0|2,0,0]=3 160 B5R0.1 CNCC(=O)O Molport-006-112-192 [0,0,1,0,0,0|2,0,0]=3 161 B5R0.1 CNCC(C)F Molport-042-670-111 [0,0,1,0,0,0|2,0,1]=4 162 B5R0.1 CNCC(C)O Molport-004-285-746 [0,0,1,0,0,0|1,0,2]=4 163 B5R0.1 COCC(=O)Cl Molport-001-794-226 [0,0,1,0,0,0|1,1,0]=3 164 B5R0.1 COCC(=O)N Molport-003-909-731 [0,0,1,0,0,0|1,1,0]=3 165 B5R0.1 COCC(=S)N Molport-004-339-486 [0,0,1,0,0,0|1,2,0]=4 166 B5R0.1 COCC(C)O Molport-001-793-107 [0,0,1,0,0,0|0,1,2]=4 167 B5R0.1 CONC(=O)N Molport-002-861-189 [0,0,1,0,0,0|2,1,0]=4 168 B5R0.1 CSCC(=N)N Molport-000-004-630 [0,0,1,0,0,0|2,0,0]=3 169 B5R0.1 N#CCC(=O)N Molport-000-150-449 [0,0,1,0,0,0|2,0,1]=4 170 B5R0.1 N#CCC(=O)O Molport-001-785-550 [0,0,1,0,0,0|2,0,1]=4 171 B5R0.1 NC(=O)CCBr Molport-001-794-093 [0,0,1,0,0,0|2,0,0]=3 172 B5R0.1 NC(=O)CCCl Molport-001-765-331 [0,0,1,0,0,0|2,0,0]=3 173 B5R0.1 NOCC(=O)O Molport-001-781-549 [0,0,1,0,0,0|2,1,0]=4 174 B5R0.1 O=C(Cl)CCBr Molport-001-792-852 [0,0,1,0,0,0|2,0,0]=3 175 B5R0.1 O=C(Cl)CCCl Molport-001-759-829 [0,0,1,0,0,0|2,0,0]=3 176 B5R0.1 O=C(O)CCBr Molport-000-152-389 [0,0,1,0,0,0|2,0,0]=3 177 B5R0.1 O=C(O)CCCl Molport-000-871-656 [0,0,1,0,0,0|2,0,0]=3 178 B5R0.1 O=C(O)CCO Molport-000-156-380 [0,0,1,0,0,0|1,1,0]=3 179 B5R0.1 O=[N+]([O-])CCO Molport-001-781-992 [0,0,1,0,0,0|2,1,0]=4 180 B5R0.2 C#CCCNC Molport-046-425-329 [0,0,1,0,0,0|2,0,1]=4 181 B5R0.2 C=CCCCN Molport-006-390-492 [0,0,1,0,0,0|3,0,0]=4 182 B5R0.2 C=CCCCN Molport-027-835-800 [0,0,1,0,0,0|3,0,0]=4 183 B5R0.2 C=CCCNC Molport-044-554-395 [0,0,1,0,0,0|2,0,0]=3 184 B5R0.2 C=CCNCC Molport-000-005-271 [0,0,1,0,0,0|2,0,0]=3 185 B5R0.2 C=CCNCC Molport-016-634-341 [0,0,1,0,0,0|2,0,0]=3 186 B5R0.2 C=CCOC=O Molport-000-005-274 [0,0,1,0,0,0|2,0,1]=4 187 B5R0.2 C=CCSC#N Molport-006-112-366 [0,0,1,0,0,0|2,0,1]=4 188 B5R0.2 CCCCC=O Molport-001-768-920 [0,0,1,0,0,0|1,0,0]=2 189 B5R0.2 CCCCCBr Molport-001-768-933 [0,0,1,0,0,0|2,0,1]=4 190 B5R0.2 CCCCCC Molport-016-899-216 [0,0,1,0,0,0|2,0,1]=4 191 B5R0.2 CCCCCI Molport-001-783-755 [0,0,1,0,0,0|2,0,1]=4 192 B5R0.2 CCCCCN Molport-001-759-278 [0,0,1,0,0,0|2,0,1]=4 193 B5R0.2 CCCCNC Molport-001-787-403 [0,0,1,0,0,0|2,0,1]=4 194 B5R0.2 CCCN=C=O Molport-001-732-519 [0,0,1,0,0,0|2,0,1]=4 195 B5R0.2 CCNCCCl Molport-039-028-247 [0,0,1,0,0,0|2,0,1]=4 196 B5R0.2 CCNCCO Molport-001-791-880 [0,0,1,0,0,0|1,0,2]=4 197 B5R0.2 CCOCCBr Molport-000-151-989 [0,0,1,0,0,0|1,1,1]=4 198 B5R0.2 CCSCC#N Molport-004-372-802 [0,0,1,0,0,0|1,0,1]=3 199 B5R0.2 CCSCCO Molport-000-155-261 [0,0,1,0,0,0|0,0,2]=3 200 B5R0.2 CNCCC#N Molport-001-791-512 [0,0,1,0,0,0|2,0,1]=4 201 B5R0.2 CNCCCN Molport-000-004-740 [0,0,1,0,0,0|2,0,1]=4 202 B5R0.2 CNCCNC Molport-046-852-851 [0,0,1,0,0,0|3,0,0]=4 203 B5R0.2 CNCCOC Molport-003-993-522 [0,0,1,0,0,0|2,1,0]=4 204 B5R0.2 CNCCSC Molport-011-940-627 [0,0,1,0,0,0|2,0,0]=3 205 B5R0.2 COCCC#N Molport-000-183-599 [0,0,1,0,0,0|1,1,1]=4 206 B5R0.2 COCCCN Molport-001-794-234 [0,0,1,0,0,0|1,1,1]=4 207 B5R0.2 COCCCO Molport-001-756-376 [0,0,1,0,0,0|0,1,2]=4 208 B5R0.2 COCCOC Molport-003-928-695 [0,0,1,0,0,0|2,1,0]=4 209 B5R0.2 COCCON Molport-008-604-171 [0,0,1,0,0,0|2,1,0]=4 210 B5R0.2 COCN=C=O Molport-004-336-498 [0,0,1,0,0,0|1,1,1]=4 211 B5R0.2 N#CCCC=O Molport-001-794-668 [0,0,1,0,0,0|2,0,0]=3 212 B5R0.3 C#CC(=O)NC Molport-020-015-098 [0,0,1,0,0,0|2,0,1]=4 213 B5R0.3 C#CC(=O)OC Molport-000-146-149 [0,0,1,0,0,0|2,0,1]=4 214 B5R0.3 C=CC(=O)OC Molport-000-872-066 [0,0,1,0,0,0|2,0,1]=4 215 B5R0.3 CC/C(=N/O)/N Molport-000-003-970 [0,0,1,0,0,0|2,1,0]=4 216 B5R0.3 CCC(=O)CC Molport-001-770-065 [0,0,1,0,0,0|1,0,0]=2 217 B5R0.3 CCC(=O)CN Molport-023-152-874 [0,0,1,0,0,0|1,0,0]=2 218 B5R0.3 CCC(=O)NN Molport-000-161-644 [0,0,1,0,0,0|2,0,0]=3 219 B5R0.3 CCC(=O)NO Molport-004-345-454 [0,0,1,0,0,0|1,1,0]=3 220 B5R0.3 CCC(=O)OC Molport-003-925-859 [0,0,1,0,0,0|2,0,0]=3 221 B5R0.3 CCC(C)CO Molport-001-783-235 [0,0,1,0,0,0|1,1,1]=4 222 B5R0.3 CCC(N)CC Molport-001-759-279 [0,0,1,0,0,0|2,0,1]=4 223 B5R0.3 CCC(N)CC Molport-004-443-422 [0,0,1,0,0,0|2,0,1]=4 224 B5R0.3 CCC(N)CO Molport-003-925-553 [0,0,1,0,0,0|1,1,1]=4 225 B5R0.3 CC[C@@H](O)CN Molport-000-001-215 [0,0,1,0,0,0|1,0,2]=4 226 B5R0.3 CNC(=O)CBr Molport-002-786-313 [0,0,1,0,0,0|2,0,0]=3 227 B5R0.3 CNC(=O)CCl Molport-000-679-703 [0,0,1,0,0,0|2,0,0]=3 228 B5R0.3 CNC(=O)CS Molport-003-938-573 [0,0,1,0,0,0|1,0,0]=2 229 B5R0.3 CNC(=O)NC Molport-000-894-312 [0,0,1,0,0,0|3,0,0]=4 230 B5R0.3 COC(=O)C#N Molport-003-929-193 [0,0,1,0,0,0|2,0,1]=4 231 B5R0.3 COC(=O)CBr Molport-001-791-817 [0,0,1,0,0,0|2,0,0]=3 232 B5R0.3 COC(=O)CCl Molport-000-871-801 [0,0,1,0,0,0|2,0,0]=3 233 B5R0.3 COC(=O)CI Molport-023-282-507 [0,0,1,0,0,0|2,0,0]=3 234 B5R0.3 COC(=O)CO Molport-001-761-942 [0,0,1,0,0,0|1,1,0]=3 235 B5R0.3 COC(=O)CS Molport-003-925-847 [0,0,1,0,0,0|1,0,0]=2 236 B5R0.3 COC(=O)NN Molport-001-640-393 [0,0,1,0,0,0|3,0,0]=4 237 B5R0.3 COC(=O)OC Molport-003-931-791 [0,0,1,0,0,0|3,0,0]=4 238 B5R0.3 NNC(=O)CO Molport-003-847-715 [0,0,1,0,0,0|2,1,0]=4 239 B5R0.3 O=C(CCl)CCl Molport-001-766-690 [0,0,1,0,0,0|2,0,0]=3 240 B7R2.13 C1CC2OC2C1 Molport-001-768-533 [0,0,0,1,0,0|1,0,2]=4 241 B5R1.2 BrC1CCC1 Molport-001-790-365 [0,0,0,0,1,0|1,0,1]=3 242 B5R1.2 C=C1CNC1 Molport-039-203-851 [0,0,0,0,1,0|2,0,0]=3 243 B5R1.2 C[C@H]1CCN1 Molport-046-162-416 [0,0,0,0,1,0|2,0,1]=4 244 B5R1.2 NC1CCC1 Molport-003-926-919 [0,0,0,0,1,0|1,0,1]=3 245 B5R1.2 OC1CNC1 Molport-001-794-113 [0,0,0,0,1,0|1,0,2]=4 246 B5R1.2 OC1COC1 Molport-006-701-036 [0,0,0,0,1,0|0,1,2]=4 247 B5R1.2 OC1CSC1 Molport-006-119-448 [0,0,0,0,1,0|0,0,2]=3 248 B7R1.3 BrC1CCCCC1 Molport-001-779-582 [0,0,0,0,0,1|2,0,1]=4 249 B7R1.3 CC1=CCC=CC1 Molport-003-960-199 [0,0,0,0,0,1|2,0,1]=4 250 B7R1.3 CC1CCCCN1 Molport-001-770-275 [0,0,0,0,0,1|2,0,1]=4 251 B7R1.3 CC1CCCCN1 Molport-053-088-428 [0,0,0,0,0,1|2,0,1]=4 252 B7R1.3 CC1CCCNC1 Molport-001-768-820 [0,0,0,0,0,1|2,0,1]=4 253 B7R1.3 CC1CCNCC1 Molport-000-157-467 [0,0,0,0,0,1|2,0,1]=4 254 B7R1.3 CC1CCNCC1 Molport-000-677-243 [0,0,0,0,0,1|2,0,1]=4 255 B7R1.3 CC1CCNCC1 Molport-028-912-924 [0,0,0,0,0,1|2,0,1]=4 256 B7R1.3 CC1CNCCN1 Molport-000-157-455 [0,0,0,0,0,1|2,0,1]=4 257 B7R1.3 CC1CNCCO1 Molport-000-004-943 [0,0,0,0,0,1|2,0,1]=4 258 B7R1.3 CC1COCCN1 Molport-000-004-929 [0,0,0,0,0,1|1,1,1]=4 259 B7R1.3 CN1CCNCC1 Molport-000-157-456 [0,0,0,0,0,1|3,0,0]=4 260 B7R1.3 CN1CCOCC1 Molport-000-882-332 [0,0,0,0,0,1|2,1,0]=4 261 B7R1.3 C[C@@H]1COCCN1 Molport-009-198-949 [0,0,0,0,0,1|1,1,1]=4 262 B7R1.3 C[C@H]1CCCCN1 Molport-027-946-860 [0,0,0,0,0,1|2,0,1]=4 263 B7R1.3 C[C@H]1CNCCN1 Molport-001-769-342 [0,0,0,0,0,1|2,0,1]=4 264 B7R1.3 FC1CCCNC1 Molport-000-155-943 [0,0,0,0,0,1|2,0,1]=4 265 B7R1.3 FC1CCNCC1 Molport-000-155-944 [0,0,0,0,0,1|2,0,1]=4 266 B7R1.3 N=C1CCCCN1 Molport-001-763-926 [0,0,0,0,0,1|2,0,0]=3 267 B7R1.3 N=C1NCCCN1 Molport-038-942-965 [0,0,0,0,0,1|3,0,0]=4 268 B7R1.3 N=C1NCCCO1 Molport-038-942-966 [0,0,0,0,0,1|3,0,0]=4 269 B7R1.3 N=C1NCCCS1 Molport-006-841-057 [0,0,0,0,0,1|3,0,0]=4 270 B7R1.3 NC1CC=CCC1 Molport-020-167-280 [0,0,0,0,0,1|2,0,1]=4 271 B7R1.3 NC1CCCCC1 Molport-000-871-531 [0,0,0,0,0,1|2,0,1]=4 272 B7R1.3 NC1CCCOC1 Molport-002-028-141 [0,0,0,0,0,1|1,1,1]=4 273 B7R1.3 NC1CCNCC1 Molport-001-768-714 [0,0,0,0,0,1|2,0,1]=4 274 B7R1.3 NC1CCOCC1 Molport-000-001-134 [0,0,0,0,0,1|1,1,1]=4 275 B7R1.3 NC1CCOCC1 Molport-001-757-424 [0,0,0,0,0,1|1,1,1]=4 276 B7R1.3 NN1CCCCC1 Molport-003-940-283 [0,0,0,0,0,1|3,0,0]=4 277 B7R1.3 NN1CCNCC1 Molport-044-830-255 [0,0,0,0,0,1|3,0,0]=4 278 B7R1.3 NN1CCOCC1 Molport-001-759-961 [0,0,0,0,0,1|2,1,0]=4 279 B7R1.3 N[C@@H]1CCCNC1 Molport-000-000-370 [0,0,0,0,0,1|2,0,1]=4 280 B7R1.3 N[C@H]1CCCNC1 Molport-000-000-371 [0,0,0,0,0,1|2,0,1]=4 281 B7R1.3 O=C1C=CCCO1 Molport-003-928-797 [0,0,0,0,0,1|1,0,1]=3 282 B7R1.3 O=C1CCCCC1 Molport-000-871-993 [0,0,0,0,0,1|1,0,0]=2 283 B7R1.3 O=C1CCCNC1 Molport-006-666-432 [0,0,0,0,0,1|1,0,0]=2 284 B7R1.3 O=C1COCCO1 Molport-003-986-736 [0,0,0,0,0,1|0,1,0]=2 285 B7R1.3 O=C1CSC=CN1 Molport-003-660-501 [0,0,0,0,0,1|0,0,2]=3 286 B7R1.3 O=C1CSCCN1 Molport-000-421-998 [0,0,0,0,0,1|0,0,0]=1 287 B7R1.3 O=S1CCCCC1 Molport-002-131-972 [0,0,0,0,0,1|2,0,0]=3 288 B7R1.3 OC1CCNCC1 Molport-001-770-948 [0,0,0,0,0,1|1,0,2]=4 289 B7R1.3 OC1CCOCC1 Molport-000-142-861 [0,0,0,0,0,1|0,1,2]=4 290 B7R1.3 O[C@H]1CCCNC1 Molport-000-004-385 [0,0,0,0,0,1|1,0,2]=4 291 B7R1.3 S=C1CCCCN1 Molport-000-884-299 [0,0,0,0,0,1|1,1,0]=3 292 B7R1.3 S=C1NCCCO1 Molport-035-717-478 [0,0,0,0,0,1|2,1,0]=4 293 B7R1.3 S=C1NCCCS1 Molport-001-758-598 [0,0,0,0,0,1|2,1,0]=4 294 B7R1.3 S=C1NCNCN1 Molport-001-763-290 [0,0,0,0,0,1|2,1,0]=4 295 B7R1.3 SC1=NCCCN1 Molport-000-510-433 [0,0,0,0,0,1|2,1,0]=4 296 B7R1.3 SC1CCCCC1 Molport-001-768-937 [0,0,0,0,0,1|1,1,1]=4 297 B7R1.3 [NH3+]C1CCCCC1 Molport-000-661-488 [0,0,0,0,0,1|2,0,1]=4 298 B4R0.1 C=C(C)CCl Molport-000-871-802 [1,0,1,0,0,0|2,0,0]=4 299 B4R0.1 C=CC(=O)C Molport-003-927-327 [1,0,1,0,0,0|0,0,2]=4 300 B4R0.1 CC(=O)C=O Molport-001-769-006 [1,0,1,0,0,0|0,1,1]=4 301 B4R0.1 CC(=O)CCl Molport-000-871-814 [1,0,1,0,0,0|1,0,0]=3 302 B4R0.1 CC(=O)C[NH3+] Molport-002-330-020 [1,0,1,0,0,0|1,0,0]=3 303 B4R0.1 CC(=O)NBr Molport-001-781-467 [1,0,1,0,0,0|2,0,0]=4 304 B4R0.1 CC(=O)NN Molport-000-882-947 [1,0,1,0,0,0|2,0,0]=4 305 B4R0.1 CC(N)CS Molport-027-713-750 [1,0,1,0,0,0|1,0,1]=4 306 B4R0.1 CCC(=N)N Molport-004-351-237 [1,0,1,0,0,0|2,0,0]=4 307 B4R0.1 CCC(=O)N Molport-003-926-455 [1,0,1,0,0,0|1,0,0]=3 308 B4R0.1 CCC(=O)O Molport-000-871-576 [1,0,1,0,0,0|0,1,0]=3 309 B4R0.1 CCC(C)Br Molport-001-768-736 [1,0,1,0,0,0|1,0,1]=4 310 B4R0.1 CCC(C)N Molport-001-768-854 [1,0,1,0,0,0|1,0,1]=4 311 B4R0.1 CCC(C)O Molport-001-783-136 [1,0,1,0,0,0|0,0,2]=4 312 B4R0.1 CCN(C)C Molport-003-925-293 [1,0,1,0,0,0|2,0,0]=4 313 B4R0.1 CCS(=O)O Molport-038-082-949 [1,0,1,0,0,0|1,1,0]=4 314 B4R0.1 CNC(=O)N Molport-001-783-302 [1,0,1,0,0,0|2,0,0]=4 315 B4R0.1 COC(=O)Cl Molport-001-791-964 [1,0,1,0,0,0|1,1,0]=4 316 B4R0.1 CSC(=N)N Molport-001-641-058 [1,0,1,0,0,0|2,0,0]=4 317 B4R0.1 NC(=O)CO Molport-001-761-952 [1,0,1,0,0,0|1,1,0]=4 318 B4R0.1 NC(=O)CS Molport-000-144-354 [1,0,1,0,0,0|1,0,0]=3 319 B4R0.1 NCC(=O)O Molport-003-936-530 [1,0,1,0,0,0|1,1,0]=4 320 B4R0.1 NC[13C](=O)O Molport-003-929-093 [1,0,1,0,0,0|1,1,0]=4 321 B4R0.1 N[13CH2][13C](=O)O Molport-003-929-140 [1,0,1,0,0,0|1,1,0]=4 322 B4R0.1 O=C(Br)CBr Molport-000-871-985 [1,0,1,0,0,0|2,0,0]=4 323 B4R0.1 O=C(Cl)CCl Molport-000-872-020 [1,0,1,0,0,0|2,0,0]=4 324 B4R0.1 O=C(O)CBr Molport-001-769-533 [1,0,1,0,0,0|1,1,0]=4 325 B4R0.1 O=C(O)CCl Molport-000-871-803 [1,0,1,0,0,0|1,1,0]=4 326 B4R0.1 O=C(O)CI Molport-002-990-500 [1,0,1,0,0,0|1,1,0]=4 327 B4R0.1 O=C(O)CO Molport-044-193-651 [1,0,1,0,0,0|1,1,0]=4 328 B4R0.1 O=C(O)CS Molport-003-935-930 [1,0,1,0,0,0|1,0,0]=3 329 B4R0.1 [15NH2]CC(=O)O Molport-003-929-547 [1,0,1,0,0,0|1,1,0]=4 330 B4R0.1 [15NH2][13CH2]C(=O)O Molport-003-929-550 [1,0,1,0,0,0|1,1,0]=4 331 B4R0.2 C/C=C/CO Molport-001-759-965 [1,0,1,0,0,0|0,1,1]=4 332 B4R0.2 C=CCCN Molport-003-937-643 [1,0,1,0,0,0|1,0,1]=4 333 B4R0.2 C=COCC Molport-000-141-310 [1,0,1,0,0,0|0,1,1]=4 334 B4R0.2 CCCC#N Molport-001-770-811 [1,0,1,0,0,0|1,0,1]=4 335 B4R0.2 CCCCBr Molport-000-875-340 [1,0,1,0,0,0|1,0,1]=4 336 B4R0.2 CCCCI Molport-001-768-334 [1,0,1,0,0,0|1,0,1]=4 337 B4R0.2 CCCCN Molport-001-788-476 [1,0,1,0,0,0|1,0,1]=4 338 B4R0.2 CCCNC Molport-001-791-508 [1,0,1,0,0,0|1,0,1]=4 339 B4R0.2 CCCNN Molport-006-701-876 [1,0,1,0,0,0|2,0,0]=4 340 B4R0.2 CCCON Molport-009-195-312 [1,0,1,0,0,0|2,0,0]=4 341 B4R0.2 CCN=C=O Molport-001-732-518 [1,0,1,0,0,0|1,0,1]=4 342 B4R0.2 CCOC=O Molport-001-766-723 [1,0,1,0,0,0|0,1,0]=3 343 B4R0.2 CNCCCl Molport-020-167-804 [1,0,1,0,0,0|2,0,0]=4 344 B4R0.2 CNCCI Molport-006-841-201 [1,0,1,0,0,0|2,0,0]=4 345 B4R0.2 COCCBr Molport-000-151-998 [1,0,1,0,0,0|1,1,0]=4 346 B4R0.2 COCCN Molport-001-787-261 [1,0,1,0,0,0|1,1,0]=4 347 B4R0.2 COCCO Molport-001-793-100 [1,0,1,0,0,0|0,1,1]=4 348 B4R0.2 COCOC Molport-003-934-233 [1,0,1,0,0,0|1,1,0]=4 349 B4R0.2 CSCC#N Molport-003-926-935 [1,0,1,0,0,0|1,0,1]=4 350 B4R0.2 CSCCN Molport-000-144-203 [1,0,1,0,0,0|1,0,0]=3 351 B4R0.2 N#CCCS Molport-006-112-773 [1,0,1,0,0,0|1,0,1]=4 352 B4R0.2 NCCCS Molport-019-922-324 [1,0,1,0,0,0|1,0,1]=4 353 B4R0.2 O=CCCO Molport-006-114-002 [1,0,1,0,0,0|0,1,0]=3 354 B4R0.2 SCCCS Molport-003-939-167 [1,0,1,0,0,0|0,1,1]=4 355 B6R0.1 C/C=C/C(=O)OC Molport-001-783-898 [0,1,1,0,0,0|1,0,1]=4 356 B6R0.1 CCCC(=O)NN Molport-000-152-665 [0,1,1,0,0,0|2,0,0]=4 357 B6R0.1 CCNC(=O)CBr Molport-001-787-874 [0,1,1,0,0,0|2,0,0]=4 358 B6R0.1 CCNC(=O)CCl Molport-002-495-438 [0,1,1,0,0,0|2,0,0]=4 359 B6R0.1 CCOC(=O)CBr Molport-000-155-170 [0,1,1,0,0,0|2,0,0]=4 360 B6R0.1 CCOC(=O)CC Molport-001-769-743 [0,1,1,0,0,0|2,0,0]=4 361 B6R0.1 CCOC(=O)CCl Molport-001-781-436 [0,1,1,0,0,0|2,0,0]=4 362 B6R0.1 CCOC(=O)CI Molport-003-928-420 [0,1,1,0,0,0|2,0,0]=4 363 B6R0.1 CCOC(=O)CN Molport-001-780-044 [0,1,1,0,0,0|2,0,0]=4 364 B6R0.1 CCOC(=O)CS Molport-002-317-318 [0,1,1,0,0,0|2,0,0]=4 365 B6R0.1 CCS(=O)CCO Molport-006-828-128 [0,1,1,0,0,0|1,1,0]=4 366 B6R0.1 CNC(=O)CC#N Molport-001-761-669 [0,1,1,0,0,0|1,0,1]=4 367 B6R0.1 CNC(=O)CCN Molport-004-310-353 [0,1,1,0,0,0|1,0,0]=3 368 B6R0.1 CNC(=O)CON Molport-035-944-370 [0,1,1,0,0,0|1,1,0]=4 369 B6R0.1 CNCC(=O)NC Molport-002-467-985 [0,1,1,0,0,0|1,0,0]=3 370 B6R0.1 CNCC(=O)NC Molport-005-310-658 [0,1,1,0,0,0|1,0,0]=3 371 B6R0.1 CNCC(=O)OC Molport-002-468-770 [0,1,1,0,0,0|1,0,0]=3 372 B6R0.1 COC(=O)CC#N Molport-001-760-458 [0,1,1,0,0,0|1,0,1]=4 373 B6R0.1 COC(=O)CCBr Molport-001-780-239 [0,1,1,0,0,0|1,0,0]=3 374 B6R0.1 COC(=O)CCCl Molport-001-785-711 [0,1,1,0,0,0|1,0,0]=3 375 B6R0.1 COC(=O)CCO Molport-001-787-796 [0,1,1,0,0,0|0,1,0]=3 376 B6R0.1 COC(=O)CCS Molport-001-766-713 [0,1,1,0,0,0|0,0,0]=2 377 B6R0.1 COCC(=O)NN Molport-000-156-737 [0,1,1,0,0,0|1,1,0]=4 378 B6R0.1 COCC(=O)OC Molport-003-926-594 [0,1,1,0,0,0|0,1,0]=3 379 B6R0.1 O=C(CCl)NCO Molport-001-762-548 [0,1,1,0,0,0|1,1,0]=4 380 B6R0.2 CC(=O)C=C(C)C Molport-000-872-030 [0,1,1,0,0,0|1,0,1]=4 381 B6R0.2 CC(=O)CC(=O)C Molport-000-871-954 [0,1,1,0,0,0|1,0,0]=3 382 B6R0.2 CC(=O)CC(=O)N Molport-003-925-054 [0,1,1,0,0,0|0,1,1]=4 383 B6R0.2 CC(=O)CC(=O)[O-] Molport-046-683-289 [0,1,1,0,0,0|0,1,1]=4 384 B6R0.2 CC(=O)CC(C)C Molport-001-789-273 [0,1,1,0,0,0|1,0,0]=3 385 B6R0.2 CC(=O)NC(C)C Molport-003-909-835 [0,1,1,0,0,0|2,0,0]=4 386 B6R0.2 CC(=O)OC(C)Cl Molport-039-062-263 [0,1,1,0,0,0|2,0,0]=4 387 B6R0.2 CC(C)CC(=O)Cl Molport-000-871-697 [0,1,1,0,0,0|2,0,0]=4 388 B6R0.2 CC(N)CC(=O)N Molport-039-240-602 [0,1,1,0,0,0|2,0,0]=4 389 B6R0.3 CCC(Br)C(=O)Cl Molport-001-781-572 [0,1,1,0,0,0|2,0,0]=4 390 B6R0.3 CCC(Br)C(=O)N Molport-009-676-971 [0,1,1,0,0,0|2,0,0]=4 391 B6R0.3 CCC(C)C(=O)O Molport-001-779-742 [0,1,1,0,0,0|2,0,0]=4 392 B6R0.3 CCC(N)C(=O)N Molport-009-753-214 [0,1,1,0,0,0|2,0,0]=4 393 B6R0.3 CCC(N)C(=O)O Molport-001-771-110 [0,1,1,0,0,0|2,0,0]=4 394 B6R0.3 CC[C@@H](O)C(=O)O Molport-003-936-425 [0,1,1,0,0,0|2,0,0]=4 395 B6R0.3 CNC(C)C(=O)N Molport-005-222-594 [0,1,1,0,0,0|2,0,0]=4 396 B6R0.3 CNC(C)C(=O)O Molport-020-000-012 [0,1,1,0,0,0|2,0,0]=4 397 B6R0.3 COC(=O)C(=O)C Molport-001-780-245 [0,1,1,0,0,0|0,1,1]=4 398 B6R0.3 COC(C)C(=O)N Molport-002-779-634 [0,1,1,0,0,0|1,1,0]=4 399 B6R0.3 NC(=O)C(N)CO Molport-004-946-904 [0,1,1,0,0,0|1,1,0]=4 400 B6R0.3 NC[C@H](N)C(=O)O Molport-027-834-922 [0,1,1,0,0,0|2,0,0]=4 401 B6R0.3 N[C@@H](CO)[13C](=O)O Molport-003-934-841 [0,1,1,0,0,0|1,1,0]=4 402 B6R0.3 N[C@H](CCl)C(=O)O Molport-020-004-719 [0,1,1,0,0,0|2,0,0]=4 403 B6R0.3 N[C@H](CS)C(=O)O Molport-003-929-589 [0,1,1,0,0,0|1,0,0]=3 404 B6R0.3 O=C(Cl)C(Br)CBr Molport-001-768-556 [0,1,1,0,0,0|2,0,0]=4 405 B6R0.3 O=C(O)C(Br)CBr Molport-001-768-555 [0,1,1,0,0,0|2,0,0]=4 406 B6R0.3 O=C(O)C(O)CCl Molport-001-786-481 [0,1,1,0,0,0|2,0,0]=4 407 B6R0.3 O=C([O-])C(=O)CS Molport-035-395-274 [0,1,1,0,0,0|1,0,1]=4 408 B6R0.3 [NH-]C(CS)C(=O)O Molport-047-739-928 [0,1,1,0,0,0|1,0,0]=3 409 B6R0.4 C#CCOC(=O)C Molport-003-936-303 [0,1,1,0,0,0|1,0,1]=4 410 B6R0.4 C=C(C)CNCC Molport-001-791-865 [0,1,1,0,0,0|2,0,0]=4 411 B6R0.4 C=CCNC(=O)C Molport-006-112-291 [0,1,1,0,0,0|1,0,1]=4 412 B6R0.4 CC(=O)CCCCl Molport-001-759-283 [0,1,1,0,0,0|1,0,0]=3 413 B6R0.4 CC(=O)NCCCl Molport-002-501-811 [0,1,1,0,0,0|1,0,0]=3 414 B6R0.4 CC(=O)NCCN Molport-001-791-776 [0,1,1,0,0,0|1,0,0]=3 415 B6R0.4 CC(=O)OCC#N Molport-016-633-541 [0,1,1,0,0,0|1,0,1]=4 416 B6R0.4 CC(=O)OCCBr Molport-001-791-955 [0,1,1,0,0,0|1,0,0]=3 417 B6R0.4 CC(=O)SCCN Molport-044-566-675 [0,1,1,0,0,0|1,0,0]=3 418 B6R0.4 CCCCC(=O)Cl Molport-001-789-178 [0,1,1,0,0,0|2,0,0]=4 419 B6R0.4 CCCOC(=O)N Molport-004-946-681 [0,1,1,0,0,0|2,0,0]=4 420 B6R0.4 CNCCC(=O)O Molport-009-286-472 [0,1,1,0,0,0|2,0,0]=4 421 B6R0.4 CO/C=C/C(=O)C Molport-003-926-096 [0,1,1,0,0,0|0,1,1]=4 422 B6R0.4 COCCC(=O)O Molport-001-794-152 [0,1,1,0,0,0|1,1,0]=4 423 B6R0.4 NC(=O)CCCCl Molport-000-860-846 [0,1,1,0,0,0|2,0,0]=4 424 B6R0.4 NCCCC(=O)Cl Molport-035-707-176 [0,1,1,0,0,0|2,0,0]=4 425 B6R0.4 NCCCC(=O)N Molport-005-312-735 [0,1,1,0,0,0|2,0,0]=4 426 B6R0.4 O=C(Cl)CCCCl Molport-001-768-913 [0,1,1,0,0,0|2,0,0]=4 427 B6R0.4 O=C(Cl)OCCCl Molport-003-928-609 [0,1,1,0,0,0|2,0,0]=4 428 B6R0.4 O=C([O-])CCCCl Molport-047-739-949 [0,1,1,0,0,0|2,0,0]=4 429 B6R0.5 CS(=O)(=O)CCN Molport-001-760-137 [0,1,1,0,0,0|2,0,0]=4 430 B6R0.5 CS(=O)(=O)CCN Molport-001-794-665 [0,1,1,0,0,0|2,0,0]=4 431 B6R0.6 BrCCSCCBr Molport-039-347-700 [0,1,1,0,0,0|1,0,1]=4 432 B6R0.6 C#CCSCCN Molport-020-167-635 [0,1,1,0,0,0|1,0,1]=4 433 B6R0.6 C=CCSCC=C Molport-003-665-654 [0,1,1,0,0,0|1,0,1]=4 434 B6R0.6 C=CCSSSC Molport-005-940-251 [0,1,1,0,0,0|2,0,0]=4 435 B6R0.6 CCCSCCN Molport-019-931-062 [0,1,1,0,0,0|1,0,1]=4 436 B6R0.6 CCSCCCO Molport-001-791-619 [0,1,1,0,0,0|0,0,2]=4 437 B6R0.6 COCCN=C=O Molport-002-039-853 [0,1,1,0,0,0|0,1,1]=4 438 B6R0.6 NCCCNC=O Molport-003-761-655 [0,1,1,0,0,0|2,0,0]=4 439 B6R0.6 NCCSCCO Molport-000-146-073 [0,1,1,0,0,0|0,0,2]=4 440 B6R0.6 O=CCCCC=O Molport-001-781-859 [0,1,1,0,0,0|1,0,1]=4 441 B6R0.8 CCS(=N)(=O)CC Molport-035-783-559 [0,1,1,0,0,0|2,0,0]=4 442 B6R1.4 CC1CCC1N Molport-038-948-316 [0,1,0,0,1,0|1,0,1]=4 443 B6R1.4 CC1CCC1O Molport-026-437-424 [0,1,0,0,1,0|0,0,2]=4 444 B6R1.4 N[C@@H]1CC[C@H]1O Molport-038-948-591 [0,1,0,0,1,0|0,0,2]=4 445 B6R1.5 C=C1CC(=O)O1 Molport-001-780-180 [0,1,0,0,1,0|0,1,1]=4 446 B6R1.6 CNC1CCC1 Molport-011-673-295 [0,1,0,0,1,0|1,0,1]=4 447 B6R1.6 NNC1CCC1 Molport-005-311-502 [0,1,0,0,1,0|1,0,1]=4 448 B6R1.6 NNC1CCC1 Molport-009-198-565 [0,1,0,0,1,0|1,0,1]=4 449 B6R1.6 O=CC1CCC1 Molport-008-156-012 [0,1,0,0,1,0|0,0,1]=3 450 B6R1.6 OCC1CCC1 Molport-000-153-743 [0,1,0,0,1,0|0,0,2]=4 451 B6R1.10 CC1(CCC1)N Molport-000-139-228 [0,1,0,0,1,0|1,0,1]=4 452 B6R1.10 O=S1(=O)CCC1 Molport-003-914-158 [0,1,0,0,1,0|1,0,0]=3 453 B6R1.10 O=S1(=O)CCN1 Molport-009-311-227 [0,1,0,0,1,0|2,0,0]=4 454 B8R1.2 C#CC1=CCCCC1 Molport-001-788-216 [0,1,0,0,0,1|2,0,0]=4 455 B8R1.2 CNC1CCSCC1 Molport-006-847-815 [0,1,0,0,0,1|1,0,1]=4 456 B8R1.2 COC1=NCCCC1 Molport-000-157-644 [0,1,0,0,0,1|1,0,1]=4 457 B8R1.2 NCC1=CCCCC1 Molport-029-997-525 [0,1,0,0,0,1|2,0,0]=4 458 B8R1.2 NCC1CCSCC1 Molport-013-119-918 [0,1,0,0,0,1|1,0,1]=4 459 B8R1.2 O=CC1=CCCOC1 Molport-000-133-054 [0,1,0,0,0,1|0,1,0]=3 460 B8R1.2 O=CC1=COCCC1 Molport-000-144-657 [0,1,0,0,0,1|0,1,1]=4 461 B8R1.2 O=CC1CC=CCC1 Molport-001-791-806 [0,1,0,0,0,1|1,0,1]=4 462 B8R1.2 O=CC1CCCCC1 Molport-001-756-386 [0,1,0,0,0,1|1,0,1]=4 463 B8R1.2 O=CC1CCCOC1 Molport-001-794-109 [0,1,0,0,0,1|0,1,1]=4 464 B8R1.2 O=CC1CCNCC1 Molport-001-761-139 [0,1,0,0,0,1|1,0,1]=4 465 B8R1.2 O=CN1CCCCC1 Molport-001-002-753 [0,1,0,0,0,1|2,0,0]=4 466 B8R1.2 O=CN1CCNCC1 Molport-001-768-828 [0,1,0,0,0,1|2,0,0]=4 467 B8R1.2 ON=C1CCOCC1 Molport-006-067-181 [0,1,0,0,0,1|0,1,1]=4 468 B8R1.2 ON=C1CCSCC1 Molport-001-762-709 [0,1,0,0,0,1|0,0,1]=3 469 B8R1.3 C=C1CCC(CC1)N Molport-038-948-726 [0,1,0,0,0,1|2,0,0]=4 470 B8R1.3 CC1=NNC(=O)CC1 Molport-003-900-973 [0,1,0,0,0,1|2,0,0]=4 471 B8R1.3 CC1CCC(=O)CC1 Molport-001-769-168 [0,1,0,0,0,1|1,0,0]=3 472 B8R1.3 CN1CCC(=O)CC1 Molport-000-146-213 [0,1,0,0,0,1|1,0,0]=3 473 B8R1.3 NC1CCC(=O)NC1 Molport-009-106-811 [0,1,0,0,0,1|1,0,0]=3 474 B8R1.3 O=C1C=CC(OC1)O Molport-022-878-873 [0,1,0,0,0,1|0,1,1]=4 475 B8R1.3 O=C1CCC(CC1)O Molport-000-004-276 [0,1,0,0,0,1|1,0,0]=3 476 B8R1.3 OC1CSC(CS1)O Molport-000-155-039 [0,1,0,0,0,1|0,0,2]=4 477 B8R1.4 CC1=CC(=O)CCC1 Molport-001-793-302 [0,1,0,0,0,1|1,0,1]=4 478 B8R1.4 CC1CCCC(=O)C1 Molport-001-793-304 [0,1,0,0,0,1|1,0,0]=3 479 B8R1.4 CC1CCN=C(C1)N Molport-035-681-776 [0,1,0,0,0,1|2,0,0]=4 480 B8R1.4 NC1=CC(=O)CCC1 Molport-000-000-303 [0,1,0,0,0,1|1,0,1]=4 481 B8R1.4 O=C1CCCC(=O)O1 Molport-001-793-730 [0,1,0,0,0,1|1,0,1]=4 482 B8R1.4 O=C1CCNC(=O)C1 Molport-006-708-369 [0,1,0,0,0,1|1,0,0]=3 483 B8R1.4 O=C1CNCC(=O)N1 Molport-020-168-252 [0,1,0,0,0,1|1,0,1]=4 484 B8R1.4 O=C1COCC(=O)N1 Molport-003-935-109 [0,1,0,0,0,1|0,1,1]=4 485 B8R1.4 O=C1CSCC(=O)O1 Molport-000-145-823 [0,1,0,0,0,1|0,0,1]=3 486 B8R1.4 O=C1NC(=S)CCS1 Molport-000-437-559 [0,1,0,0,0,1|0,1,1]=4 487 B8R1.4 S=C1CCSC(=S)N1 Molport-000-436-967 [0,1,0,0,0,1|0,1,1]=4 488 B8R1.5 CC1CCCNC1=O Molport-000-142-100 [0,1,0,0,0,1|1,0,0]=3 489 B8R1.5 CC1NCCNC1=O Molport-000-004-955 [0,1,0,0,0,1|1,0,0]=3 490 B8R1.5 CC1NCCNC1=O Molport-004-847-433 [0,1,0,0,0,1|1,0,0]=3 491 B8R1.5 CN1CCNCC1=O Molport-004-889-518 [0,1,0,0,0,1|1,0,0]=3 492 B8R1.5 N[C@@H]1CCCNC1=O Molport-000-140-494 [0,1,0,0,0,1|1,0,0]=3 493 B8R1.5 O=C1CCCCC1Cl Molport-001-780-300 [0,1,0,0,0,1|1,0,0]=3 494 B8R1.5 O=C1NCCCC1Br Molport-006-126-953 [0,1,0,0,0,1|1,0,0]=3 495 B8R1.5 O=C1NCCCC1O Molport-006-708-370 [0,1,0,0,0,1|1,0,0]=3 496 B8R1.5 O=C1NCCNC1=O Molport-003-906-150 [0,1,0,0,0,1|1,0,1]=4 497 B8R1.5 O[C@@H]1CSSC[C@H]1O Molport-002-904-173 [0,1,0,0,0,1|0,0,2]=4 498 B8R1.72 N=S1(=O)CCCCC1 Molport-044-562-458 [0,1,0,0,0,1|2,0,0]=4 499 B8R1.72 N=S1(=O)CCNCC1 Molport-044-756-145 [0,1,0,0,0,1|2,0,0]=4 500 B8R1.72 N=S1(=O)CCNCC1 Molport-047-607-848 [0,1,0,0,0,1|2,0,0]=4 501 B8R1.72 N=S1(=O)CCOCC1 Molport-020-006-452 [0,1,0,0,0,1|1,1,0]=4 502 B8R1.72 O=S1(=O)CCCCN1 Molport-001-759-458 [0,1,0,0,0,1|2,0,0]=4 503 B8R1.72 O=S1(=O)CCNCC1 Molport-000-150-507 [0,1,0,0,0,1|2,0,0]=4 504 B8R1.1 C=CC1CCC(=O)N1 Molport-015-164-231 [0,2,0,0,0,0|2,0,0]=4 505 B8R1.1 CNC1CNC(=O)C1 Molport-029-657-703 [0,2,0,0,0,0|2,0,0]=4 506 B8R1.1 COC1CCC(=O)N1 Molport-003-848-656 [0,2,0,0,0,0|2,0,0]=4 507 B8R1.1 N#CC1CNC(=O)C1 Molport-020-986-993 [0,2,0,0,0,0|2,0,0]=4 508 B8R1.1 NCC1CNC(=O)C1 Molport-009-681-517 [0,2,0,0,0,0|2,0,0]=4 509 B8R1.1 NCC1CNC(=O)C1 Molport-028-959-908 [0,2,0,0,0,0|2,0,0]=4 510 B8R1.1 O=C1CC(CN1)CBr Molport-035-826-722 [0,2,0,0,0,0|2,0,0]=4 511 B8R1.1 O=C1CC(CN1)CO Molport-006-068-999 [0,2,0,0,0,0|2,0,0]=4 512 B8R1.1 O=C1CCC(N1)CO Molport-000-004-281 [0,2,0,0,0,0|2,0,0]=4 513 B8R1.1 O=C1CCC(O1)CCl Molport-009-200-614 [0,2,0,0,0,0|2,0,0]=4 514 B8R1.7 CC(=O)C1CCNC1 Molport-028-600-513 [0,2,0,0,0,0|1,0,1]=4 515 B8R1.7 NC(=O)C1CCCC1 Molport-016-633-567 [0,2,0,0,0,0|1,0,1]=4 516 B8R1.7 NC(=O)C1CCOC1 Molport-009-013-886 [0,2,0,0,0,0|0,1,1]=4 517 B8R1.7 O=C(Cl)C1CCCC1 Molport-001-794-196 [0,2,0,0,0,0|1,0,1]=4 518 B8R1.7 O=C(Cl)C1CCOC1 Molport-009-013-740 [0,2,0,0,0,0|0,1,1]=4 519 B8R1.7 O=C(Cl)N1CCCC1 Molport-001-793-403 [0,2,0,0,0,0|2,0,0]=4 520 B8R1.7 O=C(O)C1CCNC1 Molport-002-499-434 [0,2,0,0,0,0|1,0,1]=4 521 B8R1.7 O=C([O-])C1CSCN1 Molport-006-107-116 [0,2,0,0,0,0|1,0,1]=4 522 B8R1.7 O=[N+]([O-])C1CCCC1 Molport-001-790-449 [0,2,0,0,0,0|1,0,1]=4 523 B8R1.8 O=C=NC1CCCC1 Molport-001-794-259 [0,2,0,0,0,0|1,0,1]=4 524 B8R1.8 O=C=NC1CCOC1 Molport-011-195-672 [0,2,0,0,0,0|0,1,1]=4 525 B8R1.11 C=CN1CCCC1=O Molport-003-928-295 [0,2,0,0,0,0|2,0,0]=4 526 B8R1.11 N#CC1CCCC1=O Molport-000-002-850 [0,2,0,0,0,0|1,0,0]=3 527 B8R1.11 N#CC1CSCC1=O Molport-002-551-253 [0,2,0,0,0,0|0,0,0]=2 528 B8R1.11 O=C1CCCN1CO Molport-000-873-033 [0,2,0,0,0,0|2,0,0]=4 529 B8R1.11 O=CC1CCOC1=O Molport-022-878-870 [0,2,0,0,0,0|2,0,0]=4 530 B8R1.18 CC1SC(=NC1=O)N Molport-000-469-365 [0,2,0,0,0,0|1,0,1]=4 531 B8R1.18 CC1SC(=O)NC1=O Molport-023-330-305 [0,2,0,0,0,0|1,0,1]=4 532 B8R1.18 CN1CC(CC1=O)N Molport-016-636-732 [0,2,0,0,0,0|2,0,0]=4 533 B8R1.18 NC1CC(=O)NC1=O Molport-044-660-336 [0,2,0,0,0,0|2,0,0]=4 534 B8R1.18 O=C1NC(=O)C(S1)Br Molport-002-502-349 [0,2,0,0,0,0|1,0,1]=4 535 B8R1.50 CC1CCC(=O)C1=O Molport-001-766-677 [0,2,0,0,0,0|1,0,1]=4 536 B8R1.50 CC1CCN(C1=O)C Molport-001-758-924 [0,2,0,0,0,0|2,0,0]=4 537 B8R1.50 CN1C(=O)CCC1=O Molport-000-385-147 [0,2,0,0,0,0|2,0,0]=4 538 B8R1.50 CN1C(=O)CSC1=O Molport-000-248-263 [0,2,0,0,0,0|1,0,1]=4 539 B8R1.50 CN1C(=O)CSC1=S Molport-000-500-329 [0,2,0,0,0,0|1,0,1]=4 540 B8R1.50 CN1CCC(C1=O)Br Molport-020-166-587 [0,2,0,0,0,0|2,0,0]=4 541 B8R1.50 CN1CCC(C1=O)N Molport-008-269-603 [0,2,0,0,0,0|2,0,0]=4 542 B8R1.50 CN1CCC(C1=O)O Molport-021-049-842 [0,2,0,0,0,0|2,0,0]=4 543 B8R1.50 NN1C(=O)CSC1=S Molport-000-557-975 [0,2,0,0,0,0|1,0,1]=4 544 B8R1.50 N[C@@H]1CCN(C1=O)O Molport-003-941-595 [0,2,0,0,0,0|2,0,0]=4 545 B8R1.50 O=C1COC(=O)C1Cl Molport-002-507-879 [0,2,0,0,0,0|0,1,1]=4 546 B8R1.50 O=C1CSC(=O)N1[K] Molport-044-375-934 [0,2,0,0,0,0|1,0,1]=4 547 B8R1.50 O=C1OC[C@@H]([C@H]1O)O Molport-035-784-237 [0,2,0,0,0,0|2,0,0]=4 548 B8R1.51 CC1(CC(=O)CO1)C Molport-039-241-837 [0,2,0,0,0,0|0,1,0]=3 549 B8R1.51 CC1(CCC(=O)C1)C Molport-019-796-060 [0,2,0,0,0,0|1,0,0]=3 550 B8R1.51 CC1(CCC(=O)N1)C Molport-001-781-508 [0,2,0,0,0,0|2,0,0]=4 551 B8R1.51 CC1(CNC(=O)C1)C Molport-009-194-686 [0,2,0,0,0,0|2,0,0]=4 552 B8R1.51 NC1CCS(=O)(=O)C1 Molport-000-392-384 [0,2,0,0,0,0|2,0,0]=4 553 B8R1.51 O=C1CCS(=O)(=O)O1 Molport-020-168-286 [0,2,0,0,0,0|1,0,1]=4 554 B8R1.51 O=S1(=O)CCC(C1)Br Molport-000-392-375 [0,2,0,0,0,0|2,0,0]=4 555 B8R1.51 O=S1(=O)CCC(C1)Cl Molport-000-392-373 [0,2,0,0,0,0|2,0,0]=4 556 B8R1.51 O=S1(=O)CCC(C1)O Molport-000-145-772 [0,2,0,0,0,0|2,0,0]=4 557 B8R1.51 O=S1(=O)CCC(C1)S Molport-000-392-377 [0,2,0,0,0,0|2,0,0]=4 558 B8R1.19 CC1(CCNC1=O)C Molport-009-195-986 [0,2,0,0,0,0|2,0,0]=4 559 B8R1.19 CC1(CCNC1=O)N Molport-022-364-766 [0,2,0,0,0,0|2,0,0]=4 560 B8R1.19 CC1(CCOC1=O)C Molport-009-198-442 [0,2,0,0,0,0|2,0,0]=4 561 B8R1.19 CC1(CONC1=O)C Molport-020-313-574 [0,2,0,0,0,0|1,1,0]=4 562 B8R1.19 CC1(NCCC1=O)C Molport-027-837-709 [0,2,0,0,0,0|1,0,0]=3 563 B6R1.11 NC(=O)C1CC1 Molport-001-759-958 [0,0,1,1,0,0|2,0,0]=4 564 B6R1.11 O=C(Cl)C1CC1 Molport-001-794-223 [0,0,1,1,0,0|2,0,0]=4 565 B6R1.1 C1=CCCCC1 Molport-001-779-794 [0,0,1,1,0,0|2,0,0]=4 566 B6R1.1 C1CSCCN1 Molport-003-939-584 [0,0,1,1,0,0|1,0,1]=4 567 B8R2.38 O=C1CCC2C1C2 Molport-029-498-628 [0,0,0,1,0,1|1,0,0]=3 568 B8R2.38 O=C1NCC2C1C2 Molport-028-913-001 [0,0,0,1,0,1|1,0,0]=3 569 B4R1.2 NC1CC1 Molport-000-153-790 [0,0,0,0,2,0|1,0,1]=4 570 B8R1.22 C=C1CCCNCC1 Molport-044-187-080 [0,0,0,0,0,2|2,0,0]=4 571 B8R1.22 NC1=NCCCCC1 Molport-007-996-393 [0,0,0,0,0,2|2,0,0]=4 572 B8R1.22 NC1=NCCCCC1 Molport-019-954-594 [0,0,0,0,0,2|2,0,0]=4 573 B8R1.22 O=C1CCCCCC1 Molport-001-769-691 [0,0,0,0,0,2|1,0,0]=3 574 B8R1.22 O=C1CCNCCN1 Molport-000-003-461 [0,0,0,0,0,2|1,0,0]=3 575 B8R1.22 O=C1CCNCCN1 Molport-009-197-050 [0,0,0,0,0,2|1,0,0]=3 576 B8R1.22 O=C1CCSCCN1 Molport-004-968-994 [0,0,0,0,0,2|0,0,0]=2 577 B8R1.22 O=C1CNCCCN1 Molport-000-003-463 [0,0,0,0,0,2|1,0,0]=3 578 B8R1.22 S=C1CCCCCN1 Molport-001-640-996 [0,0,0,0,0,2|1,1,0]=4 579 B8R1.22 S=C1NCCCCN1 Molport-000-144-317 [0,0,0,0,0,2|1,1,0]=4