0 B20R2.10799 CN(C)CCOC(c1ccccc1)c2ccccc2 CHEBI:4636 [0,0,0,0,0,0|0,0,0]=0 1 B20R2.10799 C[NH+](C)CCOC(c1ccccc1)c2ccccc2 CHEBI:34720 [0,0,0,0,0,0|0,0,1]=1 2 B20R2.10799 C[NH+](C)CCOC(c1ccccc1)c2ccccc2 CHEBI:4604 [0,0,0,0,0,0|0,0,1]=1 3 B20R2.10799 C[NH+](C)CCOC(c1ccccc1)c2ccccc2 CHEBI:4637 [0,0,0,0,0,0|0,0,1]=1 4 B21R2.205989 Cc1ccccc1C(c2ccccc2)OCCN(C)C CHEBI:7789 [0,1,0,0,0,0|0,0,0]=1 5 B21R2.205989 Cc1ccccc1C(c2ccccc2)OCCN(C)C CHEBI:7790 [0,1,0,0,0,0|0,0,0]=1 6 B21R2.205989 Cc1ccccc1C(c2ccccc2)OCC[NH+](C)C CHEBI:60902 [0,1,0,0,0,0|0,0,1]=2 7 B21R2.252285 CC(c1ccccc1)(c2ccccn2)OCCN(C)C CHEBI:51380 [0,1,0,0,0,0|1,0,0]=2 8 B21R2.366996 CN(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 CHEBI:31353 [0,1,0,0,0,0|1,0,0]=2 9 B21R2.366996 CN(C)CCOC(c1ccc(cc1)Cl)c2ccccn2 CHEBI:3398 [0,1,0,0,0,0|1,0,0]=2 10 B21R2.366996 CN(C)CCOC(c1ccccc1)c2ccc(cc2)Br CHEBI:59177 [0,1,0,0,0,0|0,0,0]=1 11 B21R2.366996 CN(C)CCO[C@@H](c1ccc(cc1)Cl)c2ccccn2 CHEBI:59329 [0,1,0,0,0,0|1,0,0]=2 12 B21R2.366996 CN(C)CCO[C@@H](c1ccc(cc1)Cl)c2ccccn2 CHEBI:59330 [0,1,0,0,0,0|1,0,0]=2 13 B21R2.366996 CN(C)CCO[C@@H](c1ccccc1)c2ccc(cc2)Br CHEBI:59302 [0,1,0,0,0,0|0,0,0]=1 14 B21R2.366996 CN(C)CCO[C@H](c1ccc(cc1)Cl)c2ccccn2 CHEBI:59328 [0,1,0,0,0,0|1,0,0]=2 15 B21R2.366996 CN(C)CCO[C@H](c1ccccc1)c2ccc(cc2)Br CHEBI:59301 [0,1,0,0,0,0|0,0,0]=1 16 B21R2.366996 C[NH+](C)CCOC(c1ccccc1)c2ccc(cc2)Br CHEBI:59178 [0,1,0,0,0,0|0,0,1]=2 17 B21R2.366996 C[NH+](C)CCO[C@@H](c1ccccc1)c2ccc(cc2)Br CHEBI:59305 [0,1,0,0,0,0|0,0,1]=2 18 B21R2.366996 C[NH+](C)CCO[C@H](c1ccccc1)c2ccc(cc2)Br CHEBI:59304 [0,1,0,0,0,0|0,0,1]=2 19 B21R3.12150 CN1CCOC(c2ccccc2C1)c3ccccc3 CHEBI:88318 [0,0,0,1,0,0|0,0,0]=1 20 B21R3.12150 CN1CCO[C@@H](c2ccccc2C1)c3ccccc3 CHEBI:88315 [0,0,0,1,0,0|0,0,0]=1 21 B21R3.12150 CN1CCO[C@H](c2ccccc2C1)c3ccccc3 CHEBI:88314 [0,0,0,1,0,0|0,0,0]=1 22 B21R3.12150 CN1CCO[C@H](c2ccccc2C1)c3ccccc3 CHEBI:88320 [0,0,0,1,0,0|0,0,0]=1 23 B21R3.12150 C[NH+]1CCO[C@@H](c2ccccc2C1)c3ccccc3 CHEBI:88324 [0,0,0,1,0,0|0,0,1]=2 24 B21R3.12150 C[NH+]1CCO[C@H](c2ccccc2C1)c3ccccc3 CHEBI:88325 [0,0,0,1,0,0|0,0,1]=2 25 B18R2.40 B(c1ccccc1)(c2ccccc2)OCCN CHEBI:131184 [2,0,0,0,0,0|1,0,0]=3 26 B20R2.240825 CN(C)CCC(c1ccc(cc1)Br)c2ccccn2 CHEBI:3183 [0,1,0,0,1,0|1,0,0]=3 27 B20R2.240825 CN(C)CCC(c1ccc(cc1)Br)c2ccccn2 CHEBI:3184 [0,1,0,0,1,0|1,0,0]=3 28 B20R2.240825 CN(C)CCC(c1ccc(cc1)Cl)c2ccccn2 CHEBI:52010 [0,1,0,0,1,0|1,0,0]=3 29 B20R2.240825 CN(C)CC[C@@H](c1ccc(cc1)Br)c2ccccn2 CHEBI:59269 [0,1,0,0,1,0|1,0,0]=3 30 B20R2.240825 CN(C)CC[C@@H](c1ccc(cc1)Br)c2ccccn2 CHEBI:59273 [0,1,0,0,1,0|1,0,0]=3 31 B20R2.240825 CN(C)CC[C@@H](c1ccc(cc1)Cl)c2ccccn2 CHEBI:4464 [0,1,0,0,1,0|1,0,0]=3 32 B20R2.240825 CN(C)CC[C@H](c1ccc(cc1)Cl)c2ccccn2 CHEBI:52013 [0,1,0,0,1,0|1,0,0]=3 33 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 CHEBI:3994 [0,1,0,1,0,0|1,0,0]=3 34 B22R3.1191 CN1CCN(CC1)C(c2ccccc2)c3ccccc3 CHEBI:51045 [0,1,0,1,0,0|1,0,0]=3 35 B22R3.16182945 CN(C)CCCN1c2ccccc2Sc3c1cccc3 CHEBI:8459 [0,1,0,1,0,0|2,0,0]=4 36 B22R3.16182945 CN(C)CCCN1c2ccccc2Sc3c1cccc3 CHEBI:8460 [0,1,0,1,0,0|2,0,0]=4