0 B16R2.81676 Cc1ccc(C(C)C)cc-2c(C)ccc12 Amb18511841 [0,0,0,0,0,0|0,0,0]=0 1 B15R2.9273 Cc1csc2c(Cl)cc(C(C)C)nc12 Amb27424364 [0,0,0,0,1,0|3,0,0]=4 2 B15R2.14626 CC(C)c1ccc(Br)c2ccn(C)c12 Amb28461318 [0,0,0,0,1,0|2,0,0]=3 3 B15R2.14626 Cc1ccc(C(C)C)c2c1CCC2=O Amb27390569 [0,0,0,0,1,0|1,0,2]=4 4 B14R2.9422 CC(=O)c1cccc2cccc2c1 Amb27954109 [2,0,0,0,0,0|1,0,1]=4 5 B18R2.2798960 Cc1cc(C=O)c-2c(C)ccc(C(C)C)cc12 Amb19372448 [0,2,0,0,0,0|0,0,0]=2 6 B16R2.24666 Cc1ccc2c(C)ccc(C(C)C)c2c1 Amb21855919 [0,0,1,1,0,0|0,0,0]=2 7 B14R1.758 Cc1ccc(C(C)C)cc1\C=C\CN Amb25794603 [0,0,1,0,1,0|1,0,1]=4 8 B14R1.758 Cc1ccc(C(C)C)cc1\C=C\CO Amb27853559 [0,0,1,0,1,0|1,0,1]=4 9 B14R1.4102 COc1c(C(C)C)ccc(C)c1C=O Amb27762928 [0,0,1,0,1,0|2,0,0]=4 10 B14R1.6060 CC(=O)c1c(C(C)C)ccc(C)c1O Amb27256352 [0,0,1,0,1,0|2,0,0]=4 11 B14R1.706 C=CC(=O)c1cc(C(C)C)ccc1C Amb18224843 [0,0,1,0,1,0|1,0,0]=3 12 B14R1.706 C=CC(N)c1cc(C(C)C)ccc1C Amb25694365 [0,0,1,0,1,0|1,0,1]=4 13 B14R1.706 C=CC(O)c1cc(C(C)C)ccc1C Amb26936220 [0,0,1,0,1,0|1,0,1]=4 14 B14R1.706 Cc1ccc(C(C)C)cc1C(=O)C=O Amb25056005 [0,0,1,0,1,0|2,0,0]=4 15 B14R2.1759 CCc1ccc(Br)c2scc(C)c12 Amb27192865 [1,0,0,0,1,0|2,0,0]=4 16 B14R2.1759 CCc1ccc(C)c2scc(Cl)c12 Amb27446168 [1,0,0,0,1,0|2,0,0]=4 17 B14R2.1759 CCc1ccc(Cl)c2scc(C)c12 Amb26520345 [1,0,0,0,1,0|2,0,0]=4 18 B14R2.1759 CCc1ccc(F)c2scc(C)c12 Amb27976780 [1,0,0,0,1,0|2,0,0]=4 19 B14R2.1759 CCc1ccc(S)c2scc(C)c12 Amb27818294 [1,0,0,0,1,0|2,0,0]=4 20 B14R2.1759 COc1ccc(C)c2scc(C)c12 Amb27631804 [1,0,0,0,1,0|2,0,0]=4 21 B14R2.1759 CSc1ccc(C)c2scc(C)c12 Amb27194487 [1,0,0,0,1,0|2,0,0]=4 22 B14R2.1759 Cc1ccc(CCl)c2c(C)csc12 Amb28288132 [1,0,0,0,1,0|2,0,0]=4 23 B14R2.1759 Cc1ccc(CO)c2c(C)csc12 Amb27429373 [1,0,0,0,1,0|2,0,0]=4 24 B14R2.19613 CCc1cc(Br)c2scc(C)c2c1 Amb28135163 [1,0,0,0,1,0|2,0,0]=4 25 B14R2.19613 CCc1cc(C)c2scc(Cl)c2c1 Amb28287113 [1,0,0,0,1,0|2,0,0]=4 26 B14R2.19613 CCc1cc(C)c2scc(I)c2c1 Amb27881941 [1,0,0,0,1,0|2,0,0]=4 27 B14R2.19613 CCc1cc(C)c2scc(N)c2c1 Amb27625397 [1,0,0,0,1,0|2,0,0]=4 28 B14R2.19613 CCc1cc(C)c2scc(O)c2c1 Amb27850203 [1,0,0,0,1,0|2,0,0]=4 29 B14R2.19613 CCc1cc(Cl)c2scc(C)c2c1 Amb27227177 [1,0,0,0,1,0|2,0,0]=4 30 B14R2.19613 CCc1cc(I)c2scc(C)c2c1 Amb28195398 [1,0,0,0,1,0|2,0,0]=4 31 B14R2.19613 CCc1cc(O)c2scc(C)c2c1 Amb28055657 [1,0,0,0,1,0|2,0,0]=4 32 B14R2.19613 CSc1cc(C)c2scc(C)c2c1 Amb27194488 [1,0,0,0,1,0|2,0,0]=4 33 B14R2.19613 Cc1csc2c(C)cc(CBr)cc12 Amb27616452 [1,0,0,0,1,0|2,0,0]=4 34 B14R2.19613 Cc1csc2c(C)cc(CCl)cc12 Amb27783201 [1,0,0,0,1,0|2,0,0]=4 35 B14R2.8653 Cc1ccc(C(C)C)c2c1C=CC2 Amb27591533 [1,0,0,0,1,0|0,0,1]=3 36 B14R2.24350 CC(N)c1cccc2ccn(C)c12 Amb18197556 [1,0,0,0,1,0|2,0,0]=4 37 B14R2.24350 CN(C)c1cccc2ccn(C)c12 Amb25823701 [1,0,0,0,1,0|2,0,0]=4 38 B14R2.24350 C[C@@H](N)c1cccc2ccn(C)c12 Amb33423784 [1,0,0,0,1,0|2,0,0]=4 39 B14R2.24350 C[C@@H](O)c1cccc2ccn(C)c12 Amb33423782 [1,0,0,0,1,0|2,0,0]=4 40 B14R2.24350 C[C@H](N)c1cccc2ccn(C)c12 Amb33423783 [1,0,0,0,1,0|2,0,0]=4 41 B14R2.24350 C[C@H](O)c1cccc2ccn(C)c12 Amb33226154 [1,0,0,0,1,0|2,0,0]=4 42 B14R2.24358 CC(N)c1ccc2ccn(C)c2c1 Amb18825226 [1,0,0,0,1,0|2,0,0]=4 43 B14R2.24358 CC(O)c1ccc2c(c1)C(C)C=C2 Amb28253100 [1,0,0,0,1,0|1,0,1]=4 44 B14R2.24358 C[C@@H](N)c1ccc2ccn(C)c2c1 Amb33202769 [1,0,0,0,1,0|2,0,0]=4 45 B14R2.24358 C[C@@H](O)c1ccc2ccn(C)c2c1 Amb33202766 [1,0,0,0,1,0|2,0,0]=4 46 B14R2.24358 C[C@H](N)c1ccc2ccn(C)c2c1 Amb33202768 [1,0,0,0,1,0|2,0,0]=4 47 B14R2.24358 C[C@H](O)c1ccc2ccn(C)c2c1 Amb33202765 [1,0,0,0,1,0|2,0,0]=4 48 B16R2.22890 CC(=O)c1cc(C)c2nccc(C)c2c1 Amb19104833 [0,0,0,0,1,1|1,0,1]=4 49 B16R2.22890 Cc1cc(C(C)N)nc2c(C)cccc12 Amb19104512 [0,0,0,0,1,1|2,0,0]=4 50 B16R2.22890 Cc1cc(C(C)O)nc2c(C)cccc12 Amb18353386 [0,0,0,0,1,1|2,0,0]=4 51 B16R2.22890 Cc1ccnc2c(C)cc(C(C)N)cc12 Amb19104506 [0,0,0,0,1,1|1,0,0]=3 52 B16R2.22890 Cc1ccnc2c(C)cc(C(C)O)cc12 Amb19104668 [0,0,0,0,1,1|1,0,0]=3 53 B16R2.133406 Cc1cc(C(C)C)nc2cc(Br)ccc12 Amb32687146 [0,0,0,0,1,1|2,0,0]=4 54 B16R2.133406 Cc1cc(C(C)C)nc2cc(F)ccc12 Amb32687645 [0,0,0,0,1,1|2,0,0]=4 55 B16R2.133406 Cc1cc(C(C)C)nc2cc(I)ccc12 Amb32687727 [0,0,0,0,1,1|2,0,0]=4 56 B16R2.133406 Cc1ccc2c(Cl)cc(C(C)C)nc2c1 Amb31095965 [0,0,0,0,1,1|2,0,0]=4 57 B16R2.133406 Cc1ccc2c(N)cc(C(C)C)nc2c1 Amb31112245 [0,0,0,0,1,1|2,0,0]=4