0 B20R2.2355163 COc1cc(ccc1)C2(O)CCSCC2CN(C)C Amb21994548 [0,0,0,0,0,0|1,0,0]=1 1 B20R2.2355163 COc1cccc(c1)C2(O)CCCCC2CN(C)C Amb10974899 [0,0,0,0,0,0|0,0,0]=0 2 B20R2.2355163 COc1cccc(c1)[C@@]2(O)CCCC[C@H]2CN(C)C Amb10844986 [0,0,0,0,0,0|0,0,0]=0 3 B19R2.3222 CC(C)CC1CNCCC1c2cc(ccc2)OC Amb24029023 [1,0,0,0,0,0|2,0,0]=3 4 B19R2.3222 COc1cc(ccc1)C=2CCCCC2CN(C)C Amb21961437 [1,0,0,0,0,0|0,0,2]=3 5 B19R2.3222 COc1cccc(c1)C2=C(CCCC2)CN(C)C Amb17611722 [1,0,0,0,0,0|0,0,2]=3 6 B19R2.3222 COc1cccc(c1)C2=CCCCC2CN(C)C Amb17611723 [1,0,0,0,0,0|0,0,2]=3 7 B19R2.3222 COc1ccnc(n1)N2CCCCC2CN(C)C Amb17930664 [1,0,0,0,0,0|3,0,0]=4 8 B19R2.119947 CNC[C@@H]1CCCC[C@@]1(O)c2cccc(c2)OC Amb17612292 [1,0,0,0,0,0|0,0,0]=1 9 B19R2.483078 CN(CC1CCCCC1(O)c2cccc(c2)Cl)C Amb16206176 [1,0,0,0,0,0|1,0,0]=2 10 B19R2.483078 CN(CC1CCCCC1(O)c2cccc(c2)O)C Amb17612294 [1,0,0,0,0,0|0,0,0]=1 11 B19R2.483078 CN(CC1CCCCC1(O)c2cccc(n2)Cl)C Amb16206163 [1,0,0,0,0,0|2,0,0]=3 12 B19R2.483078 CN(C[C@@H]1CCCC[C@@]1(O)c2cccc(c2)O)C Amb17612296 [1,0,0,0,0,0|0,0,0]=1 13 B19R2.483078 CN(C[C@@H]1CCCC[C@@]1(O)c2cccc(c2)O)C Amb17612297 [1,0,0,0,0,0|0,0,0]=1 14 B21R2.2656546 COc1cc(ccc1)C2(O)CCS(=O)CC2CN(C)C Amb22489128 [0,1,0,0,0,0|1,0,0]=2 15 B21R2.8778603 COc1cc(ccc1)[C@@]2(O)CCCC[C@@H]2C[N+](C)(C)[O-] Amb19134114 [0,1,0,0,0,0|0,0,1]=2 16 B19R1.52491 CC(C)OCCCNCC(O)c1cc(ccc1)OC Amb18094289 [0,0,1,0,0,0|3,0,0]=4 17 B18R1.7831 CCCCCCCCC(O)c1cc(ccc1)OC Amb23968654 [1,0,1,0,0,0|1,0,0]=3 18 B18R1.7831 CCCCCCNCC(O)c1cc(ccc1)OC Amb18605941 [1,0,1,0,0,0|2,0,0]=4 19 B18R1.287611 CCC(O)(C(C)CN(C)C)c1cc(ccc1)OC Amb22232338 [1,0,1,0,0,0|0,0,0]=2 20 B18R1.287611 CC[C@@](Cl)([C@@H](C)CN(C)C)c1cc(ccc1)OC Amb22232289 [1,0,1,0,0,0|1,0,0]=3 21 B18R1.287611 CC[C@@](O)([C@@H](C)CN(C)C)c1cc(ccc1)OC Amb22232291 [1,0,1,0,0,0|0,0,0]=2 22 B18R1.287611 CC[C@@](O)([C@H](C)CN(C)C)c1cc(ccc1)OC Amb22744945 [1,0,1,0,0,0|0,0,0]=2 23 B18R1.287611 CC[C@@](O)([C@H](C)CN(C)C)c1cc(ccc1)OC Amb22744973 [1,0,1,0,0,0|0,0,0]=2 24 B18R2.3893 CN(C)C[C@@H]1CCCC[C@H]1c2cc(O)ccc2 Amb24093293 [2,0,0,0,0,0|0,0,0]=2 25 B18R2.5170 CCCC1CNCCC1c2cc(ccc2)OC Amb24031508 [2,0,0,0,0,0|2,0,0]=4 26 B18R2.172433 NC[C@H]1CCCC[C@]1(O)c2cccc(c2)OC Amb17609580 [2,0,0,0,0,0|0,0,0]=2 27 B18R2.172433 NC[C@H]1CCCC[C@]1(O)c2cccc(c2)OC Amb17609581 [2,0,0,0,0,0|0,0,0]=2 28 B18R2.9921 CN(CC1CCCCC1(O)c2ccccn2)C Amb16206184 [2,0,0,0,0,0|1,0,0]=3 29 B20R2.3477 COc1cccc(c1)C(CCN2CCCC(C2)C)O Amb17319468 [0,0,1,1,0,0|2,0,0]=4 30 B18R1.11073 CC(C)C(NCCC)C(O)c1cc(ccc1)OC Amb18094332 [0,0,1,0,1,0|2,0,0]=4 31 B18R2.2950 COc1cccc(c1)C2CCCN2CC(C)C Amb10701317 [1,0,0,0,1,0|2,0,0]=4