0 B23R3.19444762 O=C(NCCCc1cc[n]cc1)c2[n]c3[n]ccc[n]3[n]2 Amb22629128 [0,0,0,0,0,0|4,0,0]=4 1 B23R3.19444762 O=C(NCCCc1ccccc1)C2Cc3ccccc3O2 Amb20756585 [0,0,0,0,0,0|3,0,1]=4 2 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3[nH]2 Amb19840037 [0,0,0,0,0,0|3,0,1]=4 3 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3o2 Amb20680033 [0,0,0,0,0,0|3,0,0]=3 4 B23R3.19444762 O=C(c1cc2c(o1)cccc2)NCCSc3ccccc3 Amb1901191 [0,0,0,0,0,0|4,0,0]=4 5 B22R3.3018238 c1ccc(cc1)CSCCNc2nc3c(o2)cccc3 Amb10705751 [1,0,0,0,0,0|3,0,0]=4 6 B24R3.448607 OC(CCNC(=O)c1[n]c2ccccc2[s]1)c3ccccc3 Amb21943941 [0,1,0,0,0,0|2,1,0]=4 7 B24R3.448607 OC(CCNC(=O)c1cc2ccccc2o1)c3ccccc3 Amb21940431 [0,1,0,0,0,0|3,0,0]=4 8 B24R3.2710304 O=C(c1oc2c(c1C)cccc2)NCCCc3ccccc3 Amb2134946 [0,1,0,0,0,0|3,0,0]=4 9 B24R3.11388209 Cc1cc(CCCNC(=O)c2cc3ccccc3o2)ccc1 Amb23182471 [0,1,0,0,0,0|3,0,0]=4 10 B24R3.11555009 Cc1ccc2c(n1)cc(o2)C(=O)NCCCc3ccccc3 Amb1431884 [0,1,0,0,0,0|2,0,0]=3 11 B24R3.11904236 O=C(NCCCc1ccccc1Cl)c2cc3ccccc3o2 Amb23182556 [0,1,0,0,0,0|3,0,0]=4 12 B24R3.23768342 O=C(NCCCc1ccccc1)c2cc3cccc(Br)c3o2 Amb21285971 [0,1,0,0,0,0|3,0,0]=4 13 B24R3.23768342 O=C(c1nn2c(n1)nccc2C)OCCCc3ccccc3 Amb13960502 [0,1,0,0,0,0|3,0,0]=4 14 B24R3.37409406 Cc1ccc(CCCNC(=O)c2cc3ccccc3o2)cc1 Amb23182564 [0,1,0,0,0,0|3,0,0]=4 15 B24R3.37409406 O=C(NCCCc1ccc(Cl)cc1)c2cc3ccccc3o2 Amb23182557 [0,1,0,0,0,0|3,0,0]=4 16 B24R3.37409406 O=C(NCCCc1ccc(F)cc1)c2cc3ccccc3o2 Amb23182558 [0,1,0,0,0,0|3,0,0]=4 17 B24R3.52280632 CC(NC(=O)c1cc2c(o1)cccc2)CCc3ccccc3 Amb1546963 [0,1,0,0,0,0|3,0,0]=4 18 B22R2.359951 ON(Cc1ccccc1)C(=O)CCCCc2ccccc2 Amb24073634 [0,0,1,0,0,0|3,0,0]=4 19 B24R4.1622655 O=C(N[C@@H]1CCc2ccccc21)c3c[n]4ccc[n]c4[n]3 Amb22611886 [0,0,0,1,0,0|3,0,0]=4 20 B24R4.1622655 O=C(c1cc2c(o1)cccc2)NC3CCc4c3cccc4 Amb16062201 [0,0,0,1,0,0|3,0,0]=4 21 B22R3.12500697 O=C(c1cc2c(o1)cccc2)NCCc3ccccc3 Amb1022062 [0,0,0,0,1,0|3,0,0]=4 22 B22R3.12500697 O=S(CCOc1ccccc1)c2[n]c3[n]cccc3[s]2 Amb24098870 [0,0,0,0,1,0|2,1,0]=4 23 B24R3.446311 O=C(NCCCc1ccccc1)C=2COc3ccccc3C2 Amb20533774 [0,0,0,0,0,1|3,0,0]=4 24 B24R3.28927599 O=C(Nc1nc2c([nH]1)cccc2)CCCOc3ccccc3 Amb2314225 [0,0,0,0,0,1|3,0,0]=4 25 B24R3.28927599 O=C(Nc1nc2c([nH]1)cccc2)NCCCc3ccccc3 Amb146848 [0,0,0,0,0,1|3,0,0]=4 26 B24R3.28951759 O=C(NCCCSc1ccccc1)c2c[n]3ccc[n]c3[n]2 Amb22612041 [0,0,0,0,0,1|3,0,0]=4 27 B24R3.28951759 O=C(c1cc2c(o1)cccc2)NCCCOc3ccccc3 Amb16029796 [0,0,0,0,0,1|3,0,0]=4 28 B24R3.28951759 O=C(c1cc2c(o1)cccc2)NCCCSc3ccccc3 Amb219719 [0,0,0,0,0,1|3,0,0]=4 29 B21R2.257631 O=C(NCc1ccccn1)CCCCc2ccccc2 Amb16798173 [1,0,1,0,0,0|2,0,0]=4 30 B21R2.257631 O=C(NCc1cccnc1)CCCCc2ccccc2 Amb16798174 [1,0,1,0,0,0|2,0,0]=4 31 B21R2.257631 O=C(\C=C\c1cccnc1)NCCCc2ccccc2 Amb11287162 [1,0,1,0,0,0|2,0,0]=4 32 B23R3.10389065 Cc1ccc2c(n1)cc(o2)C(=O)NCCc3ccccc3 Amb1303576 [0,1,0,0,1,0|2,0,0]=4 33 B25R3.27233317 O=C(c1nn2c(n1)nccc2C)NCCCCc3ccccc3 Amb192323 [0,1,0,0,0,1|2,0,0]=4 34 B25R4.1551014 O=C(N1CCCC1c2ccccc2)c3cc4c(o3)cccc4 Amb16142127 [0,0,0,1,0,1|2,0,0]=4 35 B25R4.441814131 O=C(c1cc2c(o1)cccc2)NC3CCCc4c3cccc4 Amb20086 [0,0,0,1,0,1|2,0,0]=4 36 B25R4.441814131 O=C(c1nc2c(s1)cccc2)NC3CCCc4c3cccc4 Amb10888063 [0,0,0,1,0,1|1,1,0]=4 37 B25R4.681662779 O=C(c1c[n]2ccc[n]c2[n]1)N3CCCCc4ccccc34 Amb19476584 [0,0,0,1,0,1|2,0,0]=4 38 B25R4.18927884 Cc1ccc2c(n1)cc(o2)C(=O)N3CCCc4c3cccc4 Amb1431904 [0,1,0,1,0,0|2,0,0]=4 39 B21R2.142835 O=C(Nc1ncccc1O)CCCOc2ccccc2 Amb15886218 [0,0,1,0,1,0|1,0,1]=4 40 B21R2.142835 O=C(Nc1ncccc1O)CCCSc2ccccc2 Amb10673885 [0,0,1,0,1,0|1,0,1]=4 41 B21R3.2429969 C(CCOc1ccccc1)c2[n]c3[n]cccc3o2 Amb18621181 [1,0,0,0,1,0|1,0,0]=3 42 B25R3.32599566 O=C(CCCOc1ccccc1)OCc2[n]c3ccccc3o2 Amb20624497 [0,0,0,0,0,2|2,0,0]=4 43 B25R3.32599566 O=C(CSc1nc2c(o1)cccn2)NCCCc3ccccc3 Amb16552118 [0,0,0,0,0,2|1,0,0]=3 44 B25R3.32645266 O=C(CCCCCCc1ccccc1)c2[n]c3[n]cccc3o2 Amb22274695 [0,0,0,0,0,2|0,0,0]=2 45 B25R3.32645266 O=C(NCCCNCc1ccccc1)c2[n]c3ccccc3[s]2 Amb21893169 [0,0,0,0,0,2|1,1,0]=4