0 B5R0.2 BrCCCCBr Molport-000-153-861 [0,0,0,0,0,0|2,0,0]=2 1 B5R0.2 C#CCCNC Molport-046-425-329 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.2 C=CCCCN Molport-006-390-492 [0,0,0,0,0,0|1,0,2]=3 3 B5R0.2 C=CCCCN Molport-027-835-800 [0,0,0,0,0,0|1,0,2]=3 4 B5R0.2 C=CCCNC Molport-044-554-395 [0,0,0,0,0,0|2,0,1]=3 5 B5R0.2 C=CCNCC Molport-000-005-271 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.2 C=CCNCC Molport-016-634-341 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.2 CC#CCCN Molport-027-845-750 [0,0,0,0,0,0|1,0,2]=3 8 B5R0.2 CC/C=C\CO Molport-000-150-381 [0,0,0,0,0,0|0,1,2]=3 9 B5R0.2 CCCCC=O Molport-001-768-920 [0,0,0,0,0,0|0,1,1]=2 10 B5R0.2 CCCCCBr Molport-001-768-933 [0,0,0,0,0,0|1,0,0]=1 11 B5R0.2 CCCCCC Molport-016-899-216 [0,0,0,0,0,0|1,0,0]=1 12 B5R0.2 CCCCCI Molport-001-783-755 [0,0,0,0,0,0|1,0,0]=1 13 B5R0.2 CCCCCN Molport-001-759-278 [0,0,0,0,0,0|1,0,0]=1 14 B5R0.2 CCCCNC Molport-001-787-403 [0,0,0,0,0,0|2,0,0]=2 15 B5R0.2 CCCN=C=O Molport-001-732-519 [0,0,0,0,0,0|1,1,1]=3 16 B5R0.2 CCNCCCl Molport-039-028-247 [0,0,0,0,0,0|2,0,0]=2 17 B5R0.2 CCNCCO Molport-001-791-880 [0,0,0,0,0,0|1,1,0]=2 18 B5R0.2 CCOCCBr Molport-000-151-989 [0,0,0,0,0,0|2,0,0]=2 19 B5R0.2 CCSCC#N Molport-004-372-802 [0,0,0,0,0,0|2,0,1]=3 20 B5R0.2 CCSCCO Molport-000-155-261 [0,0,0,0,0,0|1,1,0]=2 21 B5R0.2 CNCCC#N Molport-001-791-512 [0,0,0,0,0,0|2,0,1]=3 22 B5R0.2 CNCCCN Molport-000-004-740 [0,0,0,0,0,0|2,0,0]=2 23 B5R0.2 CNCCNC Molport-046-852-851 [0,0,0,0,0,0|3,0,0]=3 24 B5R0.2 CNCCOC Molport-003-993-522 [0,0,0,0,0,0|3,0,0]=3 25 B5R0.2 CNCCSC Molport-011-940-627 [0,0,0,0,0,0|3,0,0]=3 26 B5R0.2 COCCC#N Molport-000-183-599 [0,0,0,0,0,0|2,0,1]=3 27 B5R0.2 COCCCN Molport-001-794-234 [0,0,0,0,0,0|2,0,0]=2 28 B5R0.2 COCCCO Molport-001-756-376 [0,0,0,0,0,0|1,1,0]=2 29 B5R0.2 COCCOC Molport-003-928-695 [0,0,0,0,0,0|3,0,0]=3 30 B5R0.2 COCCON Molport-008-604-171 [0,0,0,0,0,0|3,0,0]=3 31 B5R0.2 COCN=C=O Molport-004-336-498 [0,0,0,0,0,0|2,1,1]=4 32 B5R0.2 N#CCCC=O Molport-001-794-668 [0,0,0,0,0,0|1,1,2]=4 33 B5R0.2 N#CCCCCl Molport-001-757-196 [0,0,0,0,0,0|2,0,1]=3 34 B5R0.2 N#CCCCO Molport-003-918-670 [0,0,0,0,0,0|1,1,1]=3 35 B5R0.2 NCC#CCN Molport-028-949-507 [0,0,0,0,0,0|2,0,2]=4 36 B5R0.2 NCC#CCO Molport-023-198-595 [0,0,0,0,0,0|1,1,2]=4 37 B5R0.2 NCCCCN Molport-001-781-809 [0,0,0,0,0,0|2,0,0]=2 38 B5R0.2 NCCCCS Molport-028-956-912 [0,0,0,0,0,0|1,0,0]=1 39 B5R0.2 NOCCON Molport-046-837-250 [0,0,0,0,0,0|4,0,0]=4 40 B5R0.2 O=C=NCCCl Molport-001-732-448 [0,0,0,0,0,0|2,1,1]=4 41 B5R0.2 OCC#CCO Molport-003-927-455 [0,0,0,0,0,0|1,1,2]=4 42 B5R0.2 OCCCCCl Molport-001-757-740 [0,0,0,0,0,0|1,1,0]=2 43 B4R0.2 C#CCCN Molport-004-968-587 [1,0,0,0,0,0|1,0,2]=4 44 B4R0.2 C#CCCO Molport-000-152-662 [1,0,0,0,0,0|0,1,2]=4 45 B4R0.2 C/C=C/CO Molport-001-759-965 [1,0,0,0,0,0|0,1,2]=4 46 B4R0.2 C=CCCN Molport-003-937-643 [1,0,0,0,0,0|1,0,2]=4 47 B4R0.2 C=COCC Molport-000-141-310 [1,0,0,0,0,0|1,0,2]=4 48 B4R0.2 CCCC#N Molport-001-770-811 [1,0,0,0,0,0|1,0,1]=3 49 B4R0.2 CCCCBr Molport-000-875-340 [1,0,0,0,0,0|1,0,0]=2 50 B4R0.2 CCCCI Molport-001-768-334 [1,0,0,0,0,0|1,0,0]=2 51 B4R0.2 CCCCN Molport-001-788-476 [1,0,0,0,0,0|1,0,0]=2 52 B4R0.2 CCCNC Molport-001-791-508 [1,0,0,0,0,0|1,0,0]=2 53 B4R0.2 CCCNN Molport-006-701-876 [1,0,0,0,0,0|2,0,0]=3 54 B4R0.2 CCCON Molport-009-195-312 [1,0,0,0,0,0|2,0,0]=3 55 B4R0.2 CCN=C=O Molport-001-732-518 [1,0,0,0,0,0|1,1,1]=4 56 B4R0.2 CCN=C=S Molport-000-872-053 [1,0,0,0,0,0|1,0,2]=4 57 B4R0.2 CCOC=O Molport-001-766-723 [1,0,0,0,0,0|1,1,1]=4 58 B4R0.2 CNCCCl Molport-020-167-804 [1,0,0,0,0,0|2,0,0]=3 59 B4R0.2 CNCCI Molport-006-841-201 [1,0,0,0,0,0|2,0,0]=3 60 B4R0.2 COCC#N Molport-001-768-878 [1,0,0,0,0,0|2,0,1]=4 61 B4R0.2 COCCBr Molport-000-151-998 [1,0,0,0,0,0|2,0,0]=3 62 B4R0.2 COCCN Molport-001-787-261 [1,0,0,0,0,0|2,0,0]=3 63 B4R0.2 COCCO Molport-001-793-100 [1,0,0,0,0,0|1,1,0]=3 64 B4R0.2 COCOC Molport-003-934-233 [1,0,0,0,0,0|2,0,0]=3 65 B4R0.2 COCON Molport-029-823-220 [1,0,0,0,0,0|3,0,0]=4 66 B4R0.2 CSCC#N Molport-003-926-935 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.2 CSCCN Molport-000-144-203 [1,0,0,0,0,0|2,0,0]=3 68 B4R0.2 ClCCCBr Molport-001-783-421 [1,0,0,0,0,0|2,0,0]=3 69 B4R0.2 N#CCCBr Molport-001-790-603 [1,0,0,0,0,0|2,0,1]=4 70 B4R0.2 N#CCCCl Molport-001-787-315 [1,0,0,0,0,0|2,0,1]=4 71 B4R0.2 N#CCCO Molport-001-767-916 [1,0,0,0,0,0|1,1,1]=4 72 B4R0.2 N#CCCS Molport-006-112-773 [1,0,0,0,0,0|1,0,1]=3 73 B4R0.2 NCCCBr Molport-003-925-632 [1,0,0,0,0,0|2,0,0]=3 74 B4R0.2 NCCCCl Molport-001-759-788 [1,0,0,0,0,0|2,0,0]=3 75 B4R0.2 NCCCCl Molport-001-792-701 [1,0,0,0,0,0|2,0,0]=3 76 B4R0.2 NCCCN Molport-000-871-983 [1,0,0,0,0,0|2,0,0]=3 77 B4R0.2 NCCCS Molport-019-922-324 [1,0,0,0,0,0|1,0,0]=2 78 B4R0.2 NNCCO Molport-000-003-956 [1,0,0,0,0,0|2,1,0]=4 79 B4R0.2 NOCCO Molport-008-600-593 [1,0,0,0,0,0|2,1,0]=4 80 B4R0.2 O=CCCO Molport-006-114-002 [1,0,0,0,0,0|1,1,1]=4 81 B4R0.2 OCCCCl Molport-001-756-377 [1,0,0,0,0,0|1,1,0]=3 82 B4R0.2 SCCCS Molport-003-939-167 [1,0,0,0,0,0|1,0,0]=2 83 B6R0.1 C=CCC(O)CN Molport-027-633-222 [0,1,0,0,0,0|1,0,2]=4 84 B6R0.1 CCC(C)/C=N/O Molport-013-519-041 [0,1,0,0,0,0|1,1,1]=4 85 B6R0.1 CCC(C)CCN Molport-014-184-525 [0,1,0,0,0,0|1,0,0]=2 86 B6R0.1 CCC(C)N=C=O Molport-001-732-525 [0,1,0,0,0,0|1,1,1]=4 87 B6R0.1 CCC/C(=N/O)/N Molport-000-145-251 [0,1,0,0,0,0|1,1,1]=4 88 B6R0.1 CCCC(=O)NN Molport-000-152-665 [0,1,0,0,0,0|2,0,1]=4 89 B6R0.1 CCNC(=O)CBr Molport-001-787-874 [0,1,0,0,0,0|2,0,1]=4 90 B6R0.1 CCNC(=O)CCl Molport-002-495-438 [0,1,0,0,0,0|2,0,1]=4 91 B6R0.1 CCNC(C)CO Molport-005-958-905 [0,1,0,0,0,0|1,1,0]=3 92 B6R0.1 CCOC(=O)CBr Molport-000-155-170 [0,1,0,0,0,0|2,0,1]=4 93 B6R0.1 CCOC(=O)CC Molport-001-769-743 [0,1,0,0,0,0|2,0,1]=4 94 B6R0.1 CCOC(=O)CCl Molport-001-781-436 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.1 CCOC(=O)CI Molport-003-928-420 [0,1,0,0,0,0|2,0,1]=4 96 B6R0.1 CCOC(=O)CN Molport-001-780-044 [0,1,0,0,0,0|2,0,1]=4 97 B6R0.1 CCOC(=O)CS Molport-002-317-318 [0,1,0,0,0,0|1,0,1]=3 98 B6R0.1 CCS(=O)CCO Molport-006-828-128 [0,1,0,0,0,0|1,1,0]=3 99 B6R0.1 CNC(=O)CCN Molport-004-310-353 [0,1,0,0,0,0|2,0,1]=4 100 B6R0.1 CNC(C)CCO Molport-005-958-913 [0,1,0,0,0,0|1,1,0]=3 101 B6R0.1 CNCC(O)CO Molport-002-508-201 [0,1,0,0,0,0|1,1,0]=3 102 B6R0.1 COC(=O)CCBr Molport-001-780-239 [0,1,0,0,0,0|2,0,1]=4 103 B6R0.1 COC(=O)CCCl Molport-001-785-711 [0,1,0,0,0,0|2,0,1]=4 104 B6R0.1 COC(=O)CCO Molport-001-787-796 [0,1,0,0,0,0|1,1,1]=4 105 B6R0.1 COC(=O)CCS Molport-001-766-713 [0,1,0,0,0,0|1,0,1]=3 106 B6R0.1 COCC(N)CO Molport-000-001-255 [0,1,0,0,0,0|1,1,0]=3 107 B6R0.1 COCC(O)CN Molport-000-001-153 [0,1,0,0,0,0|2,0,0]=3 108 B6R0.4 C#CCNC(C)C Molport-004-375-922 [0,1,0,0,0,0|2,0,1]=4 109 B6R0.4 C=C(C)CNCC Molport-001-791-865 [0,1,0,0,0,0|2,0,1]=4 110 B6R0.4 CC(=O)CCCCl Molport-001-759-283 [0,1,0,0,0,0|1,0,1]=3 111 B6R0.4 CC(=O)NCCCl Molport-002-501-811 [0,1,0,0,0,0|2,0,1]=4 112 B6R0.4 CC(=O)NCCN Molport-001-791-776 [0,1,0,0,0,0|2,0,1]=4 113 B6R0.4 CC(=O)OCCBr Molport-001-791-955 [0,1,0,0,0,0|2,0,1]=4 114 B6R0.4 CC(=O)SCCN Molport-044-566-675 [0,1,0,0,0,0|2,0,1]=4 115 B6R0.4 CC(Br)CCC#N Molport-006-121-010 [0,1,0,0,0,0|1,0,1]=3 116 B6R0.4 CC(C)CCCN Molport-004-308-245 [0,1,0,0,0,0|1,0,0]=2 117 B6R0.4 CC(C)CCON Molport-039-209-744 [0,1,0,0,0,0|2,0,0]=3 118 B6R0.4 CC(C)CN=C=O Molport-003-748-781 [0,1,0,0,0,0|1,1,1]=4 119 B6R0.4 CC(C)OCCBr Molport-002-465-553 [0,1,0,0,0,0|2,0,0]=3 120 B6R0.4 CC(C)OCCCl Molport-002-508-108 [0,1,0,0,0,0|2,0,0]=3 121 B6R0.4 CC(C)OCCN Molport-001-794-460 [0,1,0,0,0,0|2,0,0]=3 122 B6R0.4 CC(C)OCCO Molport-001-791-402 [0,1,0,0,0,0|1,1,0]=3 123 B6R0.4 CC(C)SCCCl Molport-008-154-301 [0,1,0,0,0,0|2,0,0]=3 124 B6R0.4 CC(N)CCCN Molport-020-866-580 [0,1,0,0,0,0|1,0,0]=2 125 B6R0.4 CCCCC(=O)Cl Molport-001-789-178 [0,1,0,0,0,0|0,1,1]=3 126 B6R0.4 CCCOC(=O)N Molport-004-946-681 [0,1,0,0,0,0|1,1,1]=4 127 B6R0.4 CCCOC(=S)[S-] Molport-002-549-259 [0,1,0,0,0,0|1,0,2]=4 128 B6R0.4 CCNCC(C)C Molport-005-312-382 [0,1,0,0,0,0|2,0,0]=3 129 B6R0.4 CN(C)CCC#N Molport-001-794-510 [0,1,0,0,0,0|2,0,1]=4 130 B6R0.4 CN(C)CCCN Molport-001-791-758 [0,1,0,0,0,0|2,0,0]=3 131 B6R0.4 CN(C)CCCO Molport-001-768-954 [0,1,0,0,0,0|1,1,0]=3 132 B6R0.4 CN(C)CCNN Molport-006-704-068 [0,1,0,0,0,0|3,0,0]=4 133 B6R0.4 CNCCC(=O)O Molport-009-286-472 [0,1,0,0,0,0|1,1,1]=4 134 B6R0.4 CNCCN(C)C Molport-001-794-238 [0,1,0,0,0,0|3,0,0]=4 135 B6R0.4 COCCC(=N)N Molport-000-004-631 [0,1,0,0,0,0|2,0,1]=4 136 B6R0.4 COCCC(=O)O Molport-001-794-152 [0,1,0,0,0,0|1,1,1]=4 137 B6R0.4 NC(=O)CCCCl Molport-000-860-846 [0,1,0,0,0,0|1,1,1]=4 138 B6R0.4 NCCCC(=O)Cl Molport-035-707-176 [0,1,0,0,0,0|1,1,1]=4 139 B6R0.4 NCCCC(=O)N Molport-005-312-735 [0,1,0,0,0,0|1,1,1]=4 140 B6R0.4 NCCCC(F)F Molport-029-944-736 [0,1,0,0,0,0|2,0,0]=3 141 B6R0.4 O=C(Cl)CCCCl Molport-001-768-913 [0,1,0,0,0,0|1,1,1]=4 142 B6R0.4 O=C([O-])CCCCl Molport-047-739-949 [0,1,0,0,0,0|1,1,1]=4 143 B6R0.6 BrCCCCCBr Molport-001-779-709 [0,1,0,0,0,0|1,0,0]=2 144 B6R0.6 BrCCNCCBr Molport-020-180-016 [0,1,0,0,0,0|2,0,0]=3 145 B6R0.6 BrCCSCCBr Molport-039-347-700 [0,1,0,0,0,0|2,0,0]=3 146 B6R0.6 C#CCCCNC Molport-039-070-665 [0,1,0,0,0,0|1,0,1]=3 147 B6R0.6 C#CCOCCBr Molport-021-874-993 [0,1,0,0,0,0|1,0,2]=4 148 B6R0.6 C#CCOCCN Molport-013-597-764 [0,1,0,0,0,0|1,0,2]=4 149 B6R0.6 C#CCOCCO Molport-006-115-826 [0,1,0,0,0,0|0,1,2]=4 150 B6R0.6 C#CCSCCN Molport-020-167-635 [0,1,0,0,0,0|1,0,2]=4 151 B6R0.6 CCCCCCBr Molport-001-783-750 [0,1,0,0,0,0|1,0,0]=2 152 B6R0.6 CCCCCCI Molport-001-783-756 [0,1,0,0,0,0|1,0,0]=2 153 B6R0.6 CCCCCCN Molport-001-768-945 [0,1,0,0,0,0|1,0,0]=2 154 B6R0.6 CCCCNCC Molport-001-791-759 [0,1,0,0,0,0|1,0,0]=2 155 B6R0.6 CCCNCCC Molport-001-791-507 [0,1,0,0,0,0|1,0,0]=2 156 B6R0.6 CCCOCCO Molport-001-791-475 [0,1,0,0,0,0|0,1,0]=2 157 B6R0.6 CCCSCCN Molport-019-931-062 [0,1,0,0,0,0|1,0,0]=2 158 B6R0.6 CCOCCCN Molport-001-791-503 [0,1,0,0,0,0|1,0,0]=2 159 B6R0.6 CCOCCNC Molport-011-940-592 [0,1,0,0,0,0|2,0,0]=3 160 B6R0.6 CCOCOCC Molport-003-934-226 [0,1,0,0,0,0|2,0,0]=3 161 B6R0.6 CCSCCCO Molport-001-791-619 [0,1,0,0,0,0|0,1,0]=2 162 B6R0.6 CNCCCCN Molport-000-004-738 [0,1,0,0,0,0|1,0,0]=2 163 B6R0.6 CNCCCOC Molport-008-643-554 [0,1,0,0,0,0|1,1,0]=3 164 B6R0.6 COCCCCN Molport-004-321-937 [0,1,0,0,0,0|1,0,0]=2 165 B6R0.6 COCCN=C=O Molport-002-039-853 [0,1,0,0,0,0|1,1,1]=4 166 B6R0.6 ClCCOCCCl Molport-000-151-535 [0,1,0,0,0,0|2,0,0]=3 167 B6R0.6 ICCOCCI Molport-000-004-398 [0,1,0,0,0,0|2,0,0]=3 168 B6R0.6 NCCCCCN Molport-002-317-350 [0,1,0,0,0,0|1,0,0]=2 169 B6R0.6 NCCCNC=O Molport-003-761-655 [0,1,0,0,0,0|1,1,1]=4 170 B6R0.6 NCCNCCN Molport-003-930-024 [0,1,0,0,0,0|2,0,0]=3 171 B6R0.6 NCCNCCO Molport-003-926-190 [0,1,0,0,0,0|1,1,0]=3 172 B6R0.6 NCCOCCCl Molport-023-282-523 [0,1,0,0,0,0|2,0,0]=3 173 B6R0.6 NCCOCCO Molport-001-791-388 [0,1,0,0,0,0|1,1,0]=3 174 B6R0.6 NCCSCCO Molport-000-146-073 [0,1,0,0,0,0|1,1,0]=3 175 B6R0.6 O=CCCCC=O Molport-001-781-859 [0,1,0,0,0,0|0,1,2]=4 176 B6R0.6 OCCCCCO Molport-001-781-608 [0,1,0,0,0,0|0,1,0]=2 177 B6R0.6 OCCOCCBr Molport-026-971-878 [0,1,0,0,0,0|1,1,0]=3 178 B6R0.6 OCCOCCF Molport-001-786-183 [0,1,0,0,0,0|1,1,0]=3 179 B6R0.6 [N-]=[N+]=NCCCN Molport-012-858-734 [0,1,0,0,0,0|3,0,0]=4 180 B6R0.6 [N-]=[N+]=NCCCO Molport-013-674-240 [0,1,0,0,0,0|2,1,0]=4 181 B6R1.1 C1=CCCCC1 Molport-001-779-794 [0,0,0,1,0,0|1,0,1]=3 182 B6R1.1 C1=COCCC1 Molport-001-760-505 [0,0,0,1,0,0|0,1,2]=4 183 B6R1.1 C1CCCCC1 Molport-001-785-799 [0,0,0,1,0,0|1,0,0]=2 184 B6R1.1 C1CNCCN1 Molport-000-872-010 [0,0,0,1,0,0|2,0,0]=3 185 B6R1.1 C1CNCCN1 Molport-003-939-135 [0,0,0,1,0,0|2,0,0]=3 186 B6R1.1 C1CNCCN1 Molport-006-108-256 [0,0,0,1,0,0|2,0,0]=3 187 B6R1.1 C1CNCOC1 Molport-020-394-588 [0,0,0,1,0,0|1,1,0]=3 188 B6R1.1 C1CSCCN1 Molport-003-939-584 [0,0,0,1,0,0|1,0,0]=2 189 B6R1.1 C1OCOCO1 Molport-003-939-763 [0,0,0,1,0,0|2,1,0]=4 190 B6R1.2 BrC1CCCC1 Molport-000-153-781 [0,0,0,1,0,0|1,0,0]=2 191 B6R1.2 CC1=NCCN1 Molport-000-525-634 [0,0,0,1,0,0|2,0,1]=4 192 B6R1.2 CC1=NNCC1 Molport-006-309-940 [0,0,0,1,0,0|2,0,1]=4 193 B6R1.2 CC1CCSC1 Molport-009-681-074 [0,0,0,1,0,0|2,0,0]=3 194 B6R1.2 C[C@H]1CCCN1 Molport-002-501-417 [0,0,0,1,0,0|1,0,0]=2 195 B6R1.2 ClC1CCCC1 Molport-001-759-290 [0,0,0,1,0,0|1,0,0]=2 196 B6R1.2 FC1CCNC1 Molport-016-637-620 [0,0,0,1,0,0|2,0,0]=3 197 B6R1.2 FC1CNOC1 Molport-051-547-803 [0,0,0,1,0,0|3,0,0]=4 198 B6R1.2 N=C1CCCN1 Molport-005-310-923 [0,0,0,1,0,0|2,0,1]=4 199 B6R1.2 NC1=NCCC1 Molport-004-968-713 [0,0,0,1,0,0|2,0,1]=4 200 B6R1.2 NC1=NCCS1 Molport-001-607-034 [0,0,0,1,0,0|2,0,1]=4 201 B6R1.2 NC1=NCCS1 Molport-001-767-657 [0,0,0,1,0,0|2,0,1]=4 202 B6R1.2 NC1CCCC1 Molport-000-871-509 [0,0,0,1,0,0|1,0,0]=2 203 B6R1.2 NC1CCNC1 Molport-002-343-989 [0,0,0,1,0,0|2,0,0]=3 204 B6R1.2 NC1CCOC1 Molport-001-794-861 [0,0,0,1,0,0|2,0,0]=3 205 B6R1.2 NC1CCSC1 Molport-004-305-541 [0,0,0,1,0,0|2,0,0]=3 206 B6R1.2 NC1CSSC1 Molport-002-320-000 [0,0,0,1,0,0|3,0,0]=4 207 B6R1.2 N[C@H]1CCOC1 Molport-005-937-196 [0,0,0,1,0,0|2,0,0]=3 208 B6R1.2 O=C1CCCC1 Molport-000-871-991 [0,0,0,1,0,0|0,1,1]=3 209 B6R1.2 O=C1CCCN1 Molport-003-928-391 [0,0,0,1,0,0|1,1,1]=4 210 B6R1.2 O=C1CCNC1 Molport-000-006-145 [0,0,0,1,0,0|1,1,1]=4 211 B6R1.2 O=C1NCCS1 Molport-002-465-761 [0,0,0,1,0,0|2,0,1]=4 212 B6R1.2 OC1CCCC1 Molport-001-759-288 [0,0,0,1,0,0|0,1,0]=2 213 B6R1.2 OC1CCNC1 Molport-000-156-385 [0,0,0,1,0,0|1,1,0]=3 214 B6R1.2 OC1CCOC1 Molport-000-156-389 [0,0,0,1,0,0|1,1,0]=3 215 B6R1.2 O[C@@H]1CCNC1 Molport-001-768-758 [0,0,0,1,0,0|1,1,0]=3 216 B6R1.2 O[C@@H]1CCSC1 Molport-035-770-278 [0,0,0,1,0,0|1,1,0]=3 217 B6R1.2 O[C@@H]1CNOC1 Molport-028-959-616 [0,0,0,1,0,0|2,1,0]=4 218 B6R1.2 O[C@H]1CCNC1 Molport-000-004-312 [0,0,0,1,0,0|1,1,0]=3 219 B6R1.2 O[C@H]1CNOC1 Molport-028-959-980 [0,0,0,1,0,0|2,1,0]=4 220 B6R1.2 SC1=NCCN1 Molport-002-345-241 [0,0,0,1,0,0|2,0,1]=4 221 B6R1.2 SC1=NCCS1 Molport-000-872-192 [0,0,0,1,0,0|2,0,1]=4 222 B6R1.3 CCNC1CC1 Molport-004-309-107 [0,0,0,1,0,0|2,0,0]=3 223 B6R1.3 COCC1CO1 Molport-003-987-095 [0,0,0,1,0,0|1,1,0]=3 224 B6R1.3 NCCC1CC1 Molport-006-389-889 [0,0,0,1,0,0|1,0,0]=2 225 B6R1.3 NNCC1CC1 Molport-005-311-503 [0,0,0,1,0,0|2,0,0]=3 226 B6R1.3 NOCC1CC1 Molport-006-666-225 [0,0,0,1,0,0|2,0,0]=3 227 B6R1.3 O=C=NC1CC1 Molport-003-748-780 [0,0,0,1,0,0|1,1,1]=4 228 B6R1.3 S=C=NC1CC1 Molport-000-146-889 [0,0,0,1,0,0|1,0,2]=4 229 B6R1.4 CC1CCC1N Molport-038-948-316 [0,0,0,1,0,0|1,0,0]=2 230 B6R1.4 CC1CCC1O Molport-026-437-424 [0,0,0,1,0,0|0,1,0]=2 231 B6R1.4 N[C@@H]1CC[C@H]1O Molport-038-948-591 [0,0,0,1,0,0|1,1,0]=3 232 B6R1.6 CCC1CNC1 Molport-044-187-793 [0,0,0,1,0,0|2,0,0]=3 233 B6R1.6 CNC1CCC1 Molport-011-673-295 [0,0,0,1,0,0|2,0,0]=3 234 B6R1.6 CSC1CNC1 Molport-020-393-119 [0,0,0,1,0,0|3,0,0]=4 235 B6R1.6 N#CC1CNC1 Molport-023-330-114 [0,0,0,1,0,0|2,0,1]=4 236 B6R1.6 NNC1CCC1 Molport-005-311-502 [0,0,0,1,0,0|2,0,0]=3 237 B6R1.6 NNC1CCC1 Molport-009-198-565 [0,0,0,1,0,0|2,0,0]=3 238 B6R1.6 O=CC1CCC1 Molport-008-156-012 [0,0,0,1,0,0|0,1,1]=3 239 B6R1.6 OCC1CCC1 Molport-000-153-743 [0,0,0,1,0,0|0,1,0]=2 240 B6R1.6 OCC1CNC1 Molport-019-879-014 [0,0,0,1,0,0|1,1,0]=3 241 B6R1.6 OCC1COC1 Molport-019-867-179 [0,0,0,1,0,0|1,1,0]=3 242 B6R1.8 CO[C@H]1C[C@H]1N Molport-047-413-065 [0,0,0,1,0,0|2,0,0]=3 243 B6R1.8 N[C@@H]1C[C@H]1CO Molport-035-765-333 [0,0,0,1,0,0|1,1,0]=3 244 B3R0.1 CCC#N Molport-001-785-582 [2,0,0,0,0,0|1,0,1]=4 245 B3R0.1 CCC=O Molport-001-769-727 [2,0,0,0,0,0|0,1,1]=4 246 B3R0.1 CCCBr Molport-000-872-093 [2,0,0,0,0,0|1,0,0]=3 247 B3R0.1 CCCI Molport-001-768-401 [2,0,0,0,0,0|1,0,0]=3 248 B3R0.1 CCCS Molport-001-782-697 [2,0,0,0,0,0|0,0,0]=2 249 B3R0.1 CCNC Molport-001-787-402 [2,0,0,0,0,0|1,0,0]=3 250 B3R0.1 CNOC Molport-002-051-971 [2,0,0,0,0,0|2,0,0]=4 251 B3R0.1 CSSC Molport-003-929-787 [2,0,0,0,0,0|2,0,0]=4 252 B3R0.1 ClCCBr Molport-003-927-012 [2,0,0,0,0,0|2,0,0]=4 253 B3R0.1 NCCBr Molport-001-759-150 [2,0,0,0,0,0|2,0,0]=4 254 B3R0.1 NCCBr Molport-036-379-908 [2,0,0,0,0,0|2,0,0]=4 255 B3R0.1 NCCCl Molport-001-756-383 [2,0,0,0,0,0|2,0,0]=4 256 B3R0.1 NCCCl Molport-001-786-398 [2,0,0,0,0,0|2,0,0]=4 257 B3R0.1 NCCN Molport-001-783-384 [2,0,0,0,0,0|2,0,0]=4 258 B3R0.1 OCCBr Molport-001-779-800 [2,0,0,0,0,0|1,1,0]=4 259 B3R0.1 OCCF Molport-001-771-679 [2,0,0,0,0,0|1,1,0]=4 260 B3R0.1 OCCI Molport-001-789-445 [2,0,0,0,0,0|1,1,0]=4 261 B3R0.1 OCCS Molport-003-938-002 [2,0,0,0,0,0|1,0,0]=3 262 B3R0.1 SCCS Molport-001-781-684 [2,0,0,0,0,0|1,0,0]=3 263 B3R0.1 [O-]CC[O-] Molport-003-899-211 [2,0,0,0,0,0|1,1,0]=4 264 B5R0.1 C=C(C)CCO Molport-003-926-226 [1,1,0,0,0,0|0,1,1]=4 265 B5R0.1 CC(=O)CCN Molport-016-899-706 [1,1,0,0,0,0|1,0,1]=4 266 B5R0.1 CC(C)CC=O Molport-001-787-528 [1,1,0,0,0,0|0,1,1]=4 267 B5R0.1 CC(C)CCBr Molport-000-875-341 [1,1,0,0,0,0|1,0,0]=3 268 B5R0.1 CC(C)CCCl Molport-001-783-738 [1,1,0,0,0,0|1,0,0]=3 269 B5R0.1 CC(C)CCI Molport-001-770-162 [1,1,0,0,0,0|1,0,0]=3 270 B5R0.1 CC(C)CCN Molport-003-927-223 [1,1,0,0,0,0|1,0,0]=3 271 B5R0.1 CC(C)CCO Molport-001-793-103 [1,1,0,0,0,0|0,1,0]=3 272 B5R0.1 CC(O)CCO Molport-003-927-418 [1,1,0,0,0,0|0,1,0]=3 273 B5R0.1 CC(O)CNN Molport-006-192-132 [1,1,0,0,0,0|2,0,0]=4 274 B5R0.1 CCCC(=O)C Molport-001-783-786 [1,1,0,0,0,0|0,0,1]=3 275 B5R0.1 CCCC(=O)Cl Molport-000-871-699 [1,1,0,0,0,0|0,1,1]=4 276 B5R0.1 CCCC(=O)O Molport-001-769-669 [1,1,0,0,0,0|0,1,1]=4 277 B5R0.1 CCC[C@H](C)N Molport-039-014-155 [1,1,0,0,0,0|0,0,0]=2 278 B5R0.1 CCC[N+](=O)[O-] Molport-003-938-817 [1,1,0,0,0,0|1,1,0]=4 279 B5R0.1 CCOC(=N)C Molport-003-925-073 [1,1,0,0,0,0|1,0,1]=4 280 B5R0.1 CN(C)CCN Molport-001-769-719 [1,1,0,0,0,0|2,0,0]=4 281 B5R0.1 CNCC(C)F Molport-042-670-111 [1,1,0,0,0,0|1,0,0]=3 282 B5R0.1 CNCC(C)O Molport-004-285-746 [1,1,0,0,0,0|1,0,0]=3 283 B5R0.1 COCC(C)O Molport-001-793-107 [1,1,0,0,0,0|1,0,0]=3 284 B5R0.1 NCCC(F)F Molport-016-636-195 [1,1,0,0,0,0|2,0,0]=4 285 B5R0.3 BrCC(Br)CBr Molport-001-779-772 [1,1,0,0,0,0|2,0,0]=4 286 B5R0.3 C=CC(O)CC Molport-001-792-065 [1,1,0,0,0,0|0,0,2]=4 287 B5R0.3 CCC(=O)CC Molport-001-770-065 [1,1,0,0,0,0|0,0,1]=3 288 B5R0.3 CCC(=O)CN Molport-023-152-874 [1,1,0,0,0,0|1,0,1]=4 289 B5R0.3 CCC(=O)OC Molport-003-925-859 [1,1,0,0,0,0|1,0,1]=4 290 B5R0.3 CCC(C)CO Molport-001-783-235 [1,1,0,0,0,0|0,1,0]=3 291 B5R0.3 CCC(N)CC Molport-001-759-279 [1,1,0,0,0,0|0,0,0]=2 292 B5R0.3 CCC(N)CC Molport-004-443-422 [1,1,0,0,0,0|0,0,0]=2 293 B5R0.3 CCC(N)CO Molport-003-925-553 [1,1,0,0,0,0|0,1,0]=3 294 B5R0.3 CC[C@@H](O)CN Molport-000-001-215 [1,1,0,0,0,0|1,0,0]=3 295 B5R0.3 CNC(=O)CS Molport-003-938-573 [1,1,0,0,0,0|1,0,1]=4 296 B5R0.3 CNC(C)CO Molport-009-200-591 [1,1,0,0,0,0|1,1,0]=4 297 B5R0.3 COC(=O)CS Molport-003-925-847 [1,1,0,0,0,0|1,0,1]=4 298 B5R0.3 C[C@@H](CN)CO Molport-023-282-274 [1,1,0,0,0,0|1,1,0]=4 299 B5R0.3 NC(CO)CO Molport-001-768-923 [1,1,0,0,0,0|1,1,0]=4 300 B5R0.3 NCC(O)CF Molport-037-963-032 [1,1,0,0,0,0|2,0,0]=4 301 B5R0.3 OC(CCl)CCl Molport-001-779-733 [1,1,0,0,0,0|2,0,0]=4 302 B5R0.3 OCC(Cl)CO Molport-006-111-471 [1,1,0,0,0,0|1,1,0]=4 303 B5R0.3 OCC(O)CCl Molport-001-779-558 [1,1,0,0,0,0|1,1,0]=4 304 B7R0.2 C#C[C@@H](N)CC(C)C Molport-051-695-351 [0,2,0,0,0,0|1,0,1]=4 305 B7R0.2 CC(C)CC(=O)CN Molport-044-548-646 [0,2,0,0,0,0|1,0,1]=4 306 B7R0.2 CCC(N)CC(=O)O Molport-006-709-500 [0,2,0,0,0,0|0,1,1]=4 307 B7R0.2 CC[C@H](N)CC(=O)O Molport-042-923-473 [0,2,0,0,0,0|0,1,1]=4 308 B7R0.2 CN(C)CC(N)CO Molport-038-948-686 [0,2,0,0,0,0|1,1,0]=4 309 B7R0.2 CN(C)CC(O)CN Molport-004-310-007 [0,2,0,0,0,0|2,0,0]=4 310 B7R0.2 NC(CO)CC(F)F Molport-021-331-693 [0,2,0,0,0,0|1,1,0]=4 311 B7R0.3 C=CCCC(C)CN Molport-021-452-967 [0,2,0,0,0,0|1,0,1]=4 312 B7R0.3 C=CCCC(C)CN Molport-046-425-328 [0,2,0,0,0,0|1,0,1]=4 313 B7R0.3 C=CCCC(N)CC Molport-044-184-648 [0,2,0,0,0,0|1,0,0]=3 314 B7R0.3 CC(CO)NCCO Molport-009-204-662 [0,2,0,0,0,0|1,1,0]=4 315 B7R0.3 CCCCC(=O)CC Molport-001-769-757 [0,2,0,0,0,0|1,0,0]=3 316 B7R0.3 CCCCC(=O)NC Molport-008-439-361 [0,2,0,0,0,0|0,1,1]=4 317 B7R0.3 CCCNC(=O)CCl Molport-000-679-709 [0,2,0,0,0,0|1,0,1]=4 318 B7R0.3 CCCNC(C)CO Molport-015-081-622 [0,2,0,0,0,0|0,1,0]=3 319 B7R0.3 CCCOC(=O)CBr Molport-001-792-409 [0,2,0,0,0,0|1,0,1]=4 320 B7R0.3 CCCOC(=O)CCl Molport-001-786-482 [0,2,0,0,0,0|1,0,1]=4 321 B7R0.3 CCCOC(C)CN Molport-008-154-264 [0,2,0,0,0,0|1,0,0]=3 322 B7R0.3 CCN(C)CCNC Molport-013-347-915 [0,2,0,0,0,0|2,0,0]=4 323 B7R0.3 CCOCC(O)CN Molport-000-001-192 [0,2,0,0,0,0|1,0,0]=3 324 B7R0.3 CCOCC(O)CN Molport-029-657-436 [0,2,0,0,0,0|1,0,0]=3 325 B7R0.3 COC(=O)CCCCl Molport-001-791-984 [0,2,0,0,0,0|1,0,1]=4 326 B7R0.3 COCCC(N)CO Molport-020-915-935 [0,2,0,0,0,0|0,1,0]=3 327 B7R0.3 CSCCC(O)CN Molport-021-604-943 [0,2,0,0,0,0|1,0,0]=3 328 B7R0.5 CC(C)C(O)CCN Molport-008-643-583 [0,2,0,0,0,0|1,0,0]=3 329 B7R0.5 CCCC(C)C(C)N Molport-039-129-648 [0,2,0,0,0,0|1,0,0]=3 330 B7R0.5 CCC[C@@H](N)C(=O)O Molport-001-792-138 [0,2,0,0,0,0|0,1,1]=4 331 B7R0.5 NCCC(O)C(F)F Molport-032-090-913 [0,2,0,0,0,0|2,0,0]=4 332 B7R0.5 N[C@H](CCS)C(=O)O Molport-020-237-559 [0,2,0,0,0,0|1,0,1]=4 333 B7R0.7 CCCC(C)NCC Molport-029-997-553 [0,2,0,0,0,0|1,0,0]=3 334 B7R0.7 CCCC(N)CCC Molport-006-842-449 [0,2,0,0,0,0|1,0,0]=3 335 B7R0.7 CCCC(O)CCO Molport-028-747-679 [0,2,0,0,0,0|0,1,0]=3 336 B7R0.7 CCC[C@@H](O)CCO Molport-044-562-472 [0,2,0,0,0,0|0,1,0]=3 337 B7R0.7 CCC[C@H](N)CCO Molport-027-835-083 [0,2,0,0,0,0|0,1,0]=3 338 B7R0.7 CCNC(=O)CCCl Molport-004-309-802 [0,2,0,0,0,0|1,0,1]=4 339 B7R0.7 CCNC(C)CCO Molport-005-958-927 [0,2,0,0,0,0|0,1,0]=3 340 B7R0.7 CCOC(=O)CCBr Molport-001-779-801 [0,2,0,0,0,0|1,0,1]=4 341 B7R0.7 CCOC(=O)CSC Molport-003-927-799 [0,2,0,0,0,0|1,0,1]=4 342 B7R0.7 CCOC(C)CNC Molport-006-710-724 [0,2,0,0,0,0|2,0,0]=4 343 B7R0.7 CNCC(O)CNC Molport-047-398-570 [0,2,0,0,0,0|2,0,0]=4 344 B7R0.7 CNCC(O)COC Molport-004-370-779 [0,2,0,0,0,0|1,1,0]=4 345 B7R0.7 O=S(CCO)CCO Molport-002-707-676 [0,2,0,0,0,0|1,1,0]=4 346 B7R0.10 CCC(=O)C(O)CC Molport-001-790-092 [0,2,0,0,0,0|1,0,1]=4 347 B7R0.10 O[C@H](CS)[C@@H](O)CS Molport-003-932-853 [0,2,0,0,0,0|1,0,0]=3 348 B7R0.11 C#CC(C)(O)CCC Molport-002-724-156 [0,2,0,0,0,0|1,0,1]=4 349 B7R0.11 CCNC(C)(C)CO Molport-006-008-668 [0,2,0,0,0,0|1,1,0]=4 350 B7R0.11 CCS(=O)(=O)CCBr Molport-006-828-175 [0,2,0,0,0,0|2,0,0]=4 351 B7R0.11 CCS(=O)(=O)CCCl Molport-005-306-906 [0,2,0,0,0,0|2,0,0]=4 352 B7R0.11 CCS(=O)(=O)CCN Molport-006-390-662 [0,2,0,0,0,0|2,0,0]=4 353 B7R0.11 CCS(=O)(=O)CCN Molport-006-847-029 [0,2,0,0,0,0|2,0,0]=4 354 B7R0.11 CNCC(C)(C)CO Molport-006-068-961 [0,2,0,0,0,0|1,1,0]=4 355 B7R0.11 COC(C)(C)CCN Molport-019-795-956 [0,2,0,0,0,0|2,0,0]=4 356 B7R0.11 COCC(C)(C)CN Molport-003-848-611 [0,2,0,0,0,0|2,0,0]=4 357 B7R0.11 COCC(C)(O)CN Molport-012-936-375 [0,2,0,0,0,0|2,0,0]=4 358 B7R0.11 COCC(C)(O)CN Molport-039-030-403 [0,2,0,0,0,0|2,0,0]=4 359 B7R0.12 CCN(CC)CCN Molport-001-783-480 [0,2,0,0,0,0|2,0,0]=4 360 B7R0.12 CCNC(CC)CC Molport-019-930-976 [0,2,0,0,0,0|2,0,0]=4 361 B7R0.12 CCOC(CC)CN Molport-029-997-670 [0,2,0,0,0,0|2,0,0]=4 362 B7R0.4 C=CCNCC(C)C Molport-003-726-538 [0,2,0,0,0,0|1,0,1]=4 363 B7R0.4 C=CCNCC(C)C Molport-009-676-786 [0,2,0,0,0,0|1,0,1]=4 364 B7R0.4 CC(=O)CCCC#N Molport-004-968-104 [0,2,0,0,0,0|1,0,1]=4 365 B7R0.4 CC(=O)NCCCN Molport-004-356-170 [0,2,0,0,0,0|1,0,1]=4 366 B7R0.4 CC(=O)NCCCO Molport-001-765-309 [0,2,0,0,0,0|0,1,1]=4 367 B7R0.4 CC(=O)OCCCO Molport-037-900-517 [0,2,0,0,0,0|0,1,1]=4 368 B7R0.4 CC(C)CCCCBr Molport-004-947-271 [0,2,0,0,0,0|1,0,0]=3 369 B7R0.4 CC(C)CCCCN Molport-011-183-366 [0,2,0,0,0,0|1,0,0]=3 370 B7R0.4 CC(C)CCN=C=O Molport-003-748-801 [0,2,0,0,0,0|0,1,1]=4 371 B7R0.4 CC(C)NCCCO Molport-002-344-315 [0,2,0,0,0,0|0,1,0]=3 372 B7R0.4 CC(C)NCCCO Molport-029-906-630 [0,2,0,0,0,0|0,1,0]=3 373 B7R0.4 CC(C)OCCCN Molport-001-791-504 [0,2,0,0,0,0|1,0,0]=3 374 B7R0.4 CCCC#CC(C)O Molport-035-924-360 [0,2,0,0,0,0|0,1,1]=4 375 B7R0.4 CCCCCC(=O)C Molport-001-759-309 [0,2,0,0,0,0|0,1,0]=3 376 B7R0.4 CCCCNC(=N)N Molport-013-619-515 [0,2,0,0,0,0|1,0,1]=4 377 B7R0.4 CCCCNC(=N)N Molport-038-949-030 [0,2,0,0,0,0|1,0,1]=4 378 B7R0.4 CCCCNC(=O)N Molport-003-927-555 [0,2,0,0,0,0|0,1,1]=4 379 B7R0.4 CCCCNC(C)C Molport-004-896-242 [0,2,0,0,0,0|1,0,0]=3 380 B7R0.4 CCCCOC(=O)N Molport-001-779-711 [0,2,0,0,0,0|0,1,1]=4 381 B7R0.4 CCCCOC(=S)[S-] Molport-002-473-007 [0,2,0,0,0,0|0,0,2]=4 382 B7R0.4 CCCNCC(F)F Molport-016-635-053 [0,2,0,0,0,0|1,0,0]=3 383 B7R0.4 CCCOCC(=O)O Molport-009-200-571 [0,2,0,0,0,0|0,1,1]=4 384 B7R0.4 CCNCCN(C)C Molport-001-791-509 [0,2,0,0,0,0|2,0,0]=4 385 B7R0.4 CNCCCC(=O)O Molport-003-928-816 [0,2,0,0,0,0|0,1,1]=4 386 B7R0.4 CNCCCC(C)C Molport-013-283-622 [0,2,0,0,0,0|1,0,0]=3 387 B7R0.4 CSCCCC(=O)O Molport-011-008-648 [0,2,0,0,0,0|0,1,1]=4 388 B7R0.4 CSCCNC(=O)C Molport-002-131-908 [0,2,0,0,0,0|1,0,1]=4 389 B7R0.4 NCCCCC(=O)O Molport-003-666-360 [0,2,0,0,0,0|0,1,1]=4 390 B7R0.4 O=C(O)CCCCS Molport-013-659-967 [0,2,0,0,0,0|0,0,1]=3 391 B7R0.6 CC(C)CNC(C)C Molport-005-312-048 [0,2,0,0,0,0|2,0,0]=4 392 B7R0.8 CC(C)(C)CCCN Molport-014-088-020 [0,2,0,0,0,0|1,0,0]=3 393 B7R0.8 CC(C)(C)OCCN Molport-028-960-410 [0,2,0,0,0,0|2,0,0]=4 394 B7R0.8 CC(C)(C)SCCN Molport-001-761-639 [0,2,0,0,0,0|2,0,0]=4 395 B7R0.8 CCCCS(=O)(=O)Cl Molport-001-791-707 [0,2,0,0,0,0|1,1,0]=4 396 B7R0.8 CCNCC(C)(C)C Molport-006-704-658 [0,2,0,0,0,0|2,0,0]=4 397 B7R0.8 CCNCC(C)(C)N Molport-014-596-641 [0,2,0,0,0,0|2,0,0]=4 398 B7R0.8 CCNCC(C)(C)N Molport-046-759-628 [0,2,0,0,0,0|2,0,0]=4 399 B7R0.8 CCNCC(F)(F)F Molport-005-312-050 [0,2,0,0,0,0|2,0,0]=4 400 B7R0.8 CCOCC(C)(C)N Molport-029-997-583 [0,2,0,0,0,0|2,0,0]=4 401 B7R0.8 CNCCC(C)(C)O Molport-016-631-094 [0,2,0,0,0,0|1,1,0]=4 402 B7R0.8 CNCCC(F)(F)F Molport-009-140-401 [0,2,0,0,0,0|2,0,0]=4 403 B7R0.8 CS(=O)(=O)CCCN Molport-009-270-718 [0,2,0,0,0,0|2,0,0]=4 404 B7R0.1 CC/C=C\CCC=O Molport-001-792-883 [0,2,0,0,0,0|0,1,1]=4 405 B7R0.1 CCCCCCCI Molport-001-768-882 [0,2,0,0,0,0|1,0,0]=3 406 B7R0.1 CCCCNCCC Molport-001-790-150 [0,2,0,0,0,0|1,0,0]=3 407 B7R0.1 CCCCNCCO Molport-000-152-572 [0,2,0,0,0,0|0,1,0]=3 408 B7R0.1 CCCCOCCO Molport-001-791-489 [0,2,0,0,0,0|0,1,0]=3 409 B7R0.1 CCCCSCCO Molport-001-791-570 [0,2,0,0,0,0|0,1,0]=3 410 B7R0.1 CCSCCCCO Molport-006-828-143 [0,2,0,0,0,0|0,1,0]=3 411 B7R0.1 COCCCN=C=O Molport-003-748-783 [0,2,0,0,0,0|0,1,1]=4 412 B7R0.1 COCCCN=C=S Molport-000-147-101 [0,2,0,0,0,0|0,0,2]=4 413 B7R0.1 COCCNCC#N Molport-004-400-503 [0,2,0,0,0,0|1,0,1]=4 414 B7R0.1 COCCOCCCl Molport-005-940-299 [0,2,0,0,0,0|1,0,0]=3 415 B7R0.1 ClCCCCCCBr Molport-003-928-399 [0,2,0,0,0,0|1,0,0]=3 416 B7R0.1 N#CCCCCC#N Molport-001-783-993 [0,2,0,0,0,0|1,0,1]=4 417 B7R0.1 N#CCCNCCO Molport-008-731-531 [0,2,0,0,0,0|0,1,1]=4 418 B7R0.1 N#CCCNCCO Molport-027-721-578 [0,2,0,0,0,0|0,1,1]=4 419 B7R0.1 N#CCCOCCCl Molport-027-807-553 [0,2,0,0,0,0|1,0,1]=4 420 B7R0.1 NCCCCCCN Molport-002-045-291 [0,2,0,0,0,0|1,0,0]=3 421 B7R0.1 NCCCNCCS Molport-029-001-943 [0,2,0,0,0,0|0,0,0]=2 422 B7R0.1 NCCCOCCO Molport-004-373-383 [0,2,0,0,0,0|0,1,0]=3 423 B7R0.1 NCC[Se][Se]CCN Molport-028-749-714 [0,2,0,0,0,0|2,0,0]=4 424 B7R0.1 OCCCNCCO Molport-003-910-318 [0,2,0,0,0,0|0,1,0]=3 425 B7R0.1 [N-]=[N+]=NCCCCN Molport-019-910-080 [0,2,0,0,0,0|2,0,0]=4 426 B5R1.1 C1=CCCC1 Molport-001-759-289 [1,0,0,1,0,0|0,0,2]=4 427 B5R1.1 C1CCCC1 Molport-001-789-854 [1,0,0,1,0,0|0,0,0]=2 428 B5R1.1 C1CCSC1 Molport-000-158-587 [1,0,0,1,0,0|0,0,0]=2 429 B5R1.2 BrC1CCC1 Molport-001-790-365 [1,0,0,1,0,0|1,0,0]=3 430 B5R1.2 C[C@H]1CCN1 Molport-046-162-416 [1,0,0,1,0,0|1,0,0]=3 431 B5R1.2 NC1CCC1 Molport-003-926-919 [1,0,0,1,0,0|1,0,0]=3 432 B5R1.2 OC1CNC1 Molport-001-794-113 [1,0,0,1,0,0|1,1,0]=4 433 B5R1.2 OC1COC1 Molport-006-701-036 [1,0,0,1,0,0|1,1,0]=4 434 B5R1.2 OC1CSC1 Molport-006-119-448 [1,0,0,1,0,0|1,1,0]=4 435 B5R1.3 C#CC1CC1 Molport-000-002-503 [1,0,0,1,0,0|0,0,2]=4 436 B5R1.3 ClCC1CC1 Molport-001-791-994 [1,0,0,1,0,0|1,0,0]=3 437 B5R1.3 ClCC1CO1 Molport-001-779-799 [1,0,0,1,0,0|1,1,0]=4 438 B5R1.3 ClCC1CO1 Molport-035-869-714 [1,0,0,1,0,0|1,1,0]=4 439 B5R1.3 ClC[C@H]1CO1 Molport-000-159-810 [1,0,0,1,0,0|1,1,0]=4 440 B5R1.3 FCC1CO1 Molport-000-005-511 [1,0,0,1,0,0|1,1,0]=4 441 B5R1.3 NCC1CC1 Molport-001-760-871 [1,0,0,1,0,0|1,0,0]=3 442 B5R1.3 NCC1CC1 Molport-003-940-243 [1,0,0,1,0,0|1,0,0]=3 443 B5R1.3 O=CC1CC1 Molport-001-791-854 [1,0,0,1,0,0|0,1,1]=4 444 B5R1.3 OCC1CC1 Molport-000-145-901 [1,0,0,1,0,0|0,1,0]=3 445 B7R1.1 BrCC1CCCC1 Molport-006-709-634 [0,1,0,1,0,0|1,0,0]=3 446 B7R1.1 BrCC1OCCO1 Molport-001-792-035 [0,1,0,1,0,0|1,1,0]=4 447 B7R1.1 C#C[C@@H]1CCCN1 Molport-035-776-851 [0,1,0,1,0,0|1,0,1]=4 448 B7R1.1 C=CC1CCNC1 Molport-035-385-684 [0,1,0,1,0,0|1,0,1]=4 449 B7R1.1 CCC1CCCN1 Molport-000-003-688 [0,1,0,1,0,0|1,0,0]=3 450 B7R1.1 CNC1CCOC1 Molport-009-198-044 [0,1,0,1,0,0|1,1,0]=4 451 B7R1.1 CNC1CCSC1 Molport-035-702-374 [0,1,0,1,0,0|1,0,0]=3 452 B7R1.1 CNC1CCSC1 Molport-046-069-764 [0,1,0,1,0,0|1,0,0]=3 453 B7R1.1 CNC1CSSC1 Molport-002-320-001 [0,1,0,1,0,0|2,0,0]=4 454 B7R1.1 CN[C@H]1CCSC1 Molport-053-096-137 [0,1,0,1,0,0|1,0,0]=3 455 B7R1.1 COC1=NCCC1 Molport-000-156-994 [0,1,0,1,0,0|1,0,1]=4 456 B7R1.1 COC1CCCC1 Molport-009-767-822 [0,1,0,1,0,0|0,1,0]=3 457 B7R1.1 CSC1CCNC1 Molport-013-582-323 [0,1,0,1,0,0|1,0,0]=3 458 B7R1.1 ClCC1CCCN1 Molport-035-716-508 [0,1,0,1,0,0|1,0,0]=3 459 B7R1.1 ClCC1CCCO1 Molport-001-780-261 [0,1,0,1,0,0|0,1,0]=3 460 B7R1.1 ClCC1OCCO1 Molport-000-871-657 [0,1,0,1,0,0|1,1,0]=4 461 B7R1.1 FCC1CCCN1 Molport-019-930-688 [0,1,0,1,0,0|1,0,0]=3 462 B7R1.1 N#CC1CCNC1 Molport-000-006-171 [0,1,0,1,0,0|1,0,1]=4 463 B7R1.1 NCC1CCCC1 Molport-003-732-830 [0,1,0,1,0,0|1,0,0]=3 464 B7R1.1 NCC1CCCO1 Molport-001-759-275 [0,1,0,1,0,0|0,1,0]=3 465 B7R1.1 NNC1CCCC1 Molport-001-769-270 [0,1,0,1,0,0|1,0,0]=3 466 B7R1.1 NNC1CCSC1 Molport-004-321-340 [0,1,0,1,0,0|2,0,0]=4 467 B7R1.1 NOC1CCCC1 Molport-008-506-590 [0,1,0,1,0,0|0,1,0]=3 468 B7R1.1 O=CC1CCOC1 Molport-001-794-100 [0,1,0,1,0,0|0,1,1]=4 469 B7R1.1 O=CN1CCCC1 Molport-002-501-742 [0,1,0,1,0,0|0,1,1]=4 470 B7R1.1 OCC1CCCO1 Molport-001-782-161 [0,1,0,1,0,0|0,1,0]=3 471 B7R1.1 OCC1CCNC1 Molport-000-006-170 [0,1,0,1,0,0|0,1,0]=3 472 B7R1.1 OC[C@@H]1CCCO1 Molport-006-708-170 [0,1,0,1,0,0|0,1,0]=3 473 B7R1.1 OC[C@H]1CCCN1 Molport-000-139-019 [0,1,0,1,0,0|0,1,0]=3 474 B7R1.2 CC1COC(O1)C Molport-006-115-302 [0,1,0,1,0,0|1,1,0]=4 475 B7R1.2 C[C@H]1CC[C@H](N1)C Molport-002-489-914 [0,1,0,1,0,0|1,0,0]=3 476 B7R1.2 N[C@@H]1CC[C@@H](C1)O Molport-023-333-453 [0,1,0,1,0,0|0,1,0]=3 477 B7R1.2 N[C@H]1CC[C@H](C1)N Molport-027-949-096 [0,1,0,1,0,0|1,0,0]=3 478 B7R1.2 N[C@H]1CC[C@H](C1)O Molport-009-684-879 [0,1,0,1,0,0|0,1,0]=3 479 B7R1.3 BrC1CCCCC1 Molport-001-779-582 [0,1,0,1,0,0|1,0,0]=3 480 B7R1.3 CC1CCCCN1 Molport-001-770-275 [0,1,0,1,0,0|1,0,0]=3 481 B7R1.3 CC1CCCCN1 Molport-053-088-428 [0,1,0,1,0,0|1,0,0]=3 482 B7R1.3 CC1CCCNC1 Molport-001-768-820 [0,1,0,1,0,0|1,0,0]=3 483 B7R1.3 CC1CCNCC1 Molport-000-157-467 [0,1,0,1,0,0|1,0,0]=3 484 B7R1.3 CC1CCNCC1 Molport-000-677-243 [0,1,0,1,0,0|1,0,0]=3 485 B7R1.3 CC1CCNCC1 Molport-028-912-924 [0,1,0,1,0,0|1,0,0]=3 486 B7R1.3 CC1CNCCN1 Molport-000-157-455 [0,1,0,1,0,0|1,0,0]=3 487 B7R1.3 CC1CNCCO1 Molport-000-004-943 [0,1,0,1,0,0|0,1,0]=3 488 B7R1.3 CC1COCCN1 Molport-000-004-929 [0,1,0,1,0,0|1,0,0]=3 489 B7R1.3 CN1CCNCC1 Molport-000-157-456 [0,1,0,1,0,0|2,0,0]=4 490 B7R1.3 CN1CCOCC1 Molport-000-882-332 [0,1,0,1,0,0|1,1,0]=4 491 B7R1.3 C[C@@H]1COCCN1 Molport-009-198-949 [0,1,0,1,0,0|1,0,0]=3 492 B7R1.3 C[C@H]1CCCCN1 Molport-027-946-860 [0,1,0,1,0,0|1,0,0]=3 493 B7R1.3 C[C@H]1CNCCN1 Molport-001-769-342 [0,1,0,1,0,0|1,0,0]=3 494 B7R1.3 FC1CCCNC1 Molport-000-155-943 [0,1,0,1,0,0|1,0,0]=3 495 B7R1.3 FC1CCNCC1 Molport-000-155-944 [0,1,0,1,0,0|1,0,0]=3 496 B7R1.3 N=C1CCCCN1 Molport-001-763-926 [0,1,0,1,0,0|1,0,1]=4 497 B7R1.3 N=C1NCCCS1 Molport-006-841-057 [0,1,0,1,0,0|1,0,1]=4 498 B7R1.3 NC1C=CCCC1 Molport-028-950-987 [0,1,0,1,0,0|1,0,1]=4 499 B7R1.3 NC1CC=CCC1 Molport-020-167-280 [0,1,0,1,0,0|1,0,1]=4 500 B7R1.3 NC1CCCCC1 Molport-000-871-531 [0,1,0,1,0,0|1,0,0]=3 501 B7R1.3 NC1CCCOC1 Molport-002-028-141 [0,1,0,1,0,0|0,1,0]=3 502 B7R1.3 NC1CCNCC1 Molport-001-768-714 [0,1,0,1,0,0|1,0,0]=3 503 B7R1.3 NC1CCOCC1 Molport-000-001-134 [0,1,0,1,0,0|0,1,0]=3 504 B7R1.3 NC1CCOCC1 Molport-001-757-424 [0,1,0,1,0,0|0,1,0]=3 505 B7R1.3 NN1CCCCC1 Molport-003-940-283 [0,1,0,1,0,0|1,0,0]=3 506 B7R1.3 NN1CCNCC1 Molport-044-830-255 [0,1,0,1,0,0|2,0,0]=4 507 B7R1.3 NN1CCOCC1 Molport-001-759-961 [0,1,0,1,0,0|1,1,0]=4 508 B7R1.3 N[C@@H]1CCCNC1 Molport-000-000-370 [0,1,0,1,0,0|1,0,0]=3 509 B7R1.3 N[C@H]1CCCNC1 Molport-000-000-371 [0,1,0,1,0,0|1,0,0]=3 510 B7R1.3 O=C1CCCCC1 Molport-000-871-993 [0,1,0,1,0,0|0,1,0]=3 511 B7R1.3 O=C1CCCNC1 Molport-006-666-432 [0,1,0,1,0,0|0,1,1]=4 512 B7R1.3 O=C1CSCCN1 Molport-000-421-998 [0,1,0,1,0,0|1,0,1]=4 513 B7R1.3 O=S1CCCCC1 Molport-002-131-972 [0,1,0,1,0,0|0,0,1]=3 514 B7R1.3 OC1CCNCC1 Molport-001-770-948 [0,1,0,1,0,0|0,1,0]=3 515 B7R1.3 OC1CCOCC1 Molport-000-142-861 [0,1,0,1,0,0|0,1,0]=3 516 B7R1.3 O[C@H]1CCCNC1 Molport-000-004-385 [0,1,0,1,0,0|0,1,0]=3 517 B7R1.3 S=C1CCCCN1 Molport-000-884-299 [0,1,0,1,0,0|0,0,2]=4 518 B7R1.3 S=C1NCCCS1 Molport-001-758-598 [0,1,0,1,0,0|1,0,1]=4 519 B7R1.3 SC1=NCCCN1 Molport-000-510-433 [0,1,0,1,0,0|1,0,1]=4 520 B7R1.3 SC1CCCCC1 Molport-001-768-937 [0,1,0,1,0,0|0,0,0]=2 521 B7R1.3 [NH3+]C1CCCCC1 Molport-000-661-488 [0,1,0,1,0,0|1,0,0]=3 522 B7R1.4 CN1CCCC1=O Molport-002-317-275 [0,1,0,1,0,0|0,1,1]=4 523 B7R1.4 NC1CCCC1O Molport-016-634-733 [0,1,0,1,0,0|0,1,0]=3 524 B7R1.4 NC1CSCC1O Molport-002-164-888 [0,1,0,1,0,0|1,1,0]=4 525 B7R1.4 N[C@@H]1CCC[C@H]1F Molport-044-811-531 [0,1,0,1,0,0|1,0,0]=3 526 B7R1.4 N[C@@H]1CCC[C@H]1O Molport-004-802-177 [0,1,0,1,0,0|0,1,0]=3 527 B7R1.4 N[C@@H]1COC[C@H]1F Molport-046-768-668 [0,1,0,1,0,0|2,0,0]=4 528 B7R1.4 N[C@@H]1COC[C@H]1O Molport-004-802-243 [0,1,0,1,0,0|1,1,0]=4 529 B7R1.4 N[C@@H]1CSC[C@@H]1O Molport-009-757-699 [0,1,0,1,0,0|1,1,0]=4 530 B7R1.4 N[C@@H]1CSC[C@H]1O Molport-009-757-770 [0,1,0,1,0,0|1,1,0]=4 531 B7R1.4 OC1CNCC1O Molport-030-005-526 [0,1,0,1,0,0|1,1,0]=4 532 B7R1.4 OC1COCC1O Molport-046-067-668 [0,1,0,1,0,0|1,1,0]=4 533 B7R1.4 O[C@H]1COC[C@H]1O Molport-003-930-575 [0,1,0,1,0,0|1,1,0]=4 534 B7R1.5 CC1CC1N=C=O Molport-004-352-087 [0,1,0,1,0,0|0,1,1]=4 535 B7R1.6 CCNC1CCC1 Molport-011-673-300 [0,1,0,1,0,0|1,0,0]=3 536 B7R1.6 FCCC1CNC1 Molport-046-676-019 [0,1,0,1,0,0|1,0,0]=3 537 B7R1.6 O=C=NC1CCC1 Molport-004-338-929 [0,1,0,1,0,0|0,1,1]=4 538 B7R1.9 CCC1CC1CN Molport-039-240-433 [0,1,0,1,0,0|1,0,0]=3 539 B7R1.9 NCC1C[C@@H]1CO Molport-051-995-332 [0,1,0,1,0,0|0,1,0]=3 540 B7R1.10 CCN1CC(C1)O Molport-020-393-149 [0,1,0,1,0,0|1,1,0]=4 541 B7R1.10 CSC1CC(C1)O Molport-044-636-351 [0,1,0,1,0,0|1,1,0]=4 542 B7R1.21 CCCC1(CC1)N Molport-029-997-538 [0,1,0,1,0,0|1,0,0]=3 543 B7R1.22 CC(NN)C1CC1 Molport-016-633-872 [0,1,0,1,0,0|2,0,0]=4 544 B7R1.22 CCC(N)C1CC1 Molport-011-913-977 [0,1,0,1,0,0|1,0,0]=3 545 B7R1.22 N#CC(N)C1CC1 Molport-016-636-733 [0,1,0,1,0,0|1,0,1]=4 546 B7R1.22 NC(CO)C1CC1 Molport-020-166-670 [0,1,0,1,0,0|0,1,0]=3 547 B7R1.22 O=C(CBr)C1CC1 Molport-004-760-246 [0,1,0,1,0,0|1,0,1]=4 548 B7R1.22 O=C(CO)C1CC1 Molport-020-682-299 [0,1,0,1,0,0|0,1,1]=4 549 B7R1.25 C#CC1(CCC1)N Molport-039-070-817 [0,1,0,1,0,0|1,0,1]=4 550 B7R1.25 CC1(CCC1)CBr Molport-026-972-006 [0,1,0,1,0,0|1,0,0]=3 551 B7R1.25 CC1(CCC1)CO Molport-009-199-738 [0,1,0,1,0,0|0,1,0]=3 552 B7R1.25 CC1(COC1)CI Molport-009-196-111 [0,1,0,1,0,0|2,0,0]=4 553 B7R1.25 CC1(COC1)CN Molport-002-678-833 [0,1,0,1,0,0|2,0,0]=4 554 B7R1.25 CC1(COC1)CO Molport-001-791-448 [0,1,0,1,0,0|1,1,0]=4 555 B7R1.27 CC1(CC1Br)CO Molport-004-781-442 [0,1,0,1,0,0|1,1,0]=4 556 B7R1.7 CCCCC1CO1 Molport-003-811-664 [0,1,0,1,0,0|0,1,0]=3 557 B7R1.7 CCCNC1CC1 Molport-004-307-330 [0,1,0,1,0,0|1,0,0]=3 558 B7R1.7 O=C=NCC1CC1 Molport-013-117-774 [0,1,0,1,0,0|0,1,1]=4 559 B7R1.7 OCCNC1CC1 Molport-004-322-439 [0,1,0,1,0,0|0,1,0]=3 560 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Molport-006-109-402 [0,1,0,1,0,0|0,1,1]=4 561 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Molport-028-948-974 [0,1,0,1,0,0|0,1,1]=4 562 B7R1.14 CC1(CCCN1)C Molport-001-781-707 [0,1,0,1,0,0|1,0,0]=3 563 B7R1.14 CC1(CCNC1)C Molport-006-703-025 [0,1,0,1,0,0|2,0,0]=4 564 B7R1.14 N=S1(=O)CCCC1 Molport-029-996-241 [0,1,0,1,0,0|1,1,0]=4 565 B7R1.14 O=S1(=O)CCCC1 Molport-000-392-376 [0,1,0,1,0,0|1,1,0]=4 566 B7R1.18 C[C@H](N)C1CCC1 Molport-029-939-234 [0,1,0,1,0,0|1,0,0]=3 567 B7R1.18 FC(F)C1CNC1 Molport-023-231-696 [0,1,0,1,0,0|2,0,0]=4 568 B7R1.18 NC(=O)C1CCC1 Molport-003-873-345 [0,1,0,1,0,0|0,1,1]=4 569 B7R1.18 OB(O)C1CCC1 Molport-003-938-221 [0,1,0,1,0,0|1,1,0]=4 570 B7R1.20 CN(C)CC1CC1 Molport-046-842-919 [0,1,0,1,0,0|2,0,0]=4 571 B7R1.20 O=C(O)CC1CC1 Molport-000-153-788 [0,1,0,1,0,0|0,1,1]=4 572 B7R1.20 O=[N+]([O-])CC1CC1 Molport-035-929-591 [0,1,0,1,0,0|1,1,0]=4 573 B7R1.23 OCC1CC1(F)F Molport-000-160-066 [0,1,0,1,0,0|1,1,0]=4 574 B7R1.24 C1CCCNCC1 Molport-000-871-530 [0,1,0,1,0,0|1,0,0]=3 575 B7R1.24 C1CCNCNC1 Molport-047-739-953 [0,1,0,1,0,0|1,0,0]=3 576 B7R1.24 C1CNCCNC1 Molport-000-146-168 [0,1,0,1,0,0|1,0,0]=3 577 B7R1.24 C1CNCCOC1 Molport-005-232-050 [0,1,0,1,0,0|0,1,0]=3 578 B7R1.24 C1CNCCSC1 Molport-016-634-515 [0,1,0,1,0,0|0,0,0]=2 579 B7R2.13 C1CC2OC2C1 Molport-001-768-533 [0,0,0,2,0,0|0,1,0]=3