0 B16R2.3270 NC(=O)c1ccc(o1)c2ccccc2Cl CSC000017085 [0,0,0,0,0,0|1,0,0]=1 1 B16R2.3270 NC(=O)c1ccc(o1)c2ccccc2F CSC000016473 [0,0,0,0,0,0|1,1,0]=2 2 B16R2.3270 OC(=O)c1ccc(s1)c2ccccc2Cl CSC000740630 [0,0,0,0,0,0|0,1,0]=1 3 B15R2.59 NC(=O)c1ccc(o1)c2ccccc2 CSC000010916 [1,0,0,0,0,0|1,0,0]=2 4 B15R2.59 OC(=O)c1cc(c[nH]1)c2ccccc2 CSC000118222 [1,0,0,0,0,0|2,0,0]=3 5 B15R2.59 OC(=O)c1csc(n1)c2cccnc2 CSC011219305 [1,0,0,0,0,0|3,0,0]=4 6 B17R2.566 COC(=O)c1cc([nH]n1)c2ccccc2Cl CSC000695577 [0,1,0,0,0,0|3,0,0]=4 7 B17R2.566 COC(=O)c1ccc(o1)c2ccccc2Cl CSC000016578 [0,1,0,0,0,0|0,0,0]=1 8 B17R2.566 COC(=O)c1csc(n1)c2ccccc2F CSC011528889 [0,1,0,0,0,0|2,1,0]=4 9 B17R2.566 NNC(=O)c1ccc(o1)c2ccccc2Cl CSC000016790 [0,1,0,0,0,0|1,0,0]=2 10 B17R2.3390 Cc1c(cccc1c2ccc(o2)C(=O)O)Cl CSC000187359 [0,1,0,0,0,0|1,0,0]=2 11 B17R2.3390 OC(=O)c1csc(n1)c2cccc(c2Cl)Cl CSC011260865 [0,1,0,0,0,0|2,0,0]=3 12 B17R2.3935 Cc1ccccc1c2ccc(cc2)C(=O)O CSC011216752 [0,0,0,0,0,1|2,0,0]=3 13 B17R2.3935 NC(=O)c1ccc(cc1)c2ccccc2F CSC000023390 [0,0,0,0,0,1|2,1,0]=4 14 B17R2.3935 OC(=O)c1ccc(cc1)c2ccccc2Cl CSC011217429 [0,0,0,0,0,1|1,0,0]=2 15 B17R2.3935 OC(=O)c1ccc(cc1)c2ccccc2F CSC011217417 [0,0,0,0,0,1|1,1,0]=3 16 B17R2.3948 Cc1ccccc1c2cccc(c2)C(=O)O CSC011217142 [0,0,0,0,0,1|2,0,0]=3 17 B17R2.3948 OC(=O)c1cccc(c1)c2ccccc2Cl CSC000239303 [0,0,0,0,0,1|1,0,0]=2 18 B17R2.3948 OC(=O)c1cccc(c1)c2ccccc2F CSC011217267 [0,0,0,0,0,1|1,1,0]=3 19 B14R2.256 Cc1ccc(o1)c2ccccc2N CSC011217610 [2,0,0,0,0,0|1,0,1]=4 20 B16R2.141 COC(=O)c1ccn(n1)c2ccccc2 CSC011294768 [1,1,0,0,0,0|2,0,0]=4 21 B16R2.141 COC(=O)c1coc(n1)c2ccccc2 CSC000028505 [1,1,0,0,0,0|2,0,0]=4 22 B16R2.2865 Cc1ccc(cc1)c2ccc(o2)C(=O)O CSC000186495 [1,1,0,0,0,0|0,0,0]=2 23 B16R2.2865 Cc1ccc(cc1)c2ccc(s2)C(=O)O CSC011217629 [1,1,0,0,0,0|0,1,0]=3 24 B16R2.2865 NC(=O)c1ccc(s1)c2ccc(cc2)Cl CSC000017084 [1,1,0,0,0,0|1,1,0]=4 25 B16R2.2865 OC(=O)c1cc(c[nH]1)c2ccc(cc2)F CSC010073819 [1,1,0,0,0,0|2,0,0]=4 26 B16R2.2888 Cn1cc(cc1C(=O)O)c2ccccc2 CSC010074124 [1,1,0,0,0,0|2,0,0]=4 27 B16R2.2918 Cc1cccc(c1)c2ccc(o2)C(=O)O CSC000186492 [1,1,0,0,0,0|0,0,0]=2 28 B16R2.2918 OC(=O)c1ccc(o1)c2cccc(c2)Cl CSC000189161 [1,1,0,0,0,0|0,0,0]=2 29 B18R2.3050 COc1ccccc1c2ccc(cc2)C(=O)O CSC000297572 [0,1,0,0,0,1|2,0,0]=4 30 B18R2.4057 OC(=O)c1ccc(cc1)c2ccc(cc2F)F CSC005482677 [0,1,0,0,0,1|1,1,0]=4 31 B18R2.4063 Cc1ccc(c(c1)c2cccc(c2)C(=O)O)C CSC005482673 [0,1,0,0,0,1|2,0,0]=4 32 B18R2.4737 Cc1ccccc1c2ccc(c(c2)C(=O)O)O CSC000297775 [0,1,0,0,0,1|2,0,0]=4 33 B18R2.12470 COc1ccccc1c2cccc(c2)C(=O)O CSC000283064 [0,1,0,0,0,1|2,0,0]=4 34 B18R2.66875 OC(=O)c1cccc(c1)c2ccc(cc2F)F CSC005482679 [0,1,0,0,0,1|1,1,0]=4 35 B18R2.66875 OC(=O)c1ccnc(c1)c2ccc(cc2F)F CSC015370313 [0,1,0,0,0,1|1,1,0]=4 36 B18R2.8097 CCOC(=O)c1coc(n1)c2ccccc2Cl CSC020626065 [0,2,0,0,0,0|2,0,0]=4 37 B18R2.8097 CCOC(=O)c1csc(n1)c2ccccc2Cl CSC005709976 [0,2,0,0,0,0|2,0,0]=4 38 B18R2.3929 Cc1nc(sc1C(=O)O)c2cccc(c2Cl)Cl CSC000322876 [0,2,0,0,0,0|1,1,0]=4 39 B18R3.138718 COC(=O)c1cc2sc3ccccc3c2s1 CSC036992935 [0,1,0,1,0,0|1,1,0]=4 40 B14R1.550 OC(=O)C(=Cc1ccccc1Cl)C#N CSC000162681 [0,0,1,0,1,0|1,0,1]=4 41 B14R2.53 OC(=O)c1ccc(o1)c2ccsc2 CSC011997837 [1,0,0,0,1,0|1,0,0]=3 42 B14R2.53 OC(=O)c1ccc(s1)c2ccsc2 CSC011606056 [1,0,0,0,1,0|1,1,0]=4 43 B16R2.85 NC(=O)c1ccc(cc1)c2ccccc2 CSC000003340 [1,0,0,0,0,1|2,0,0]=4 44 B16R2.85 OC(=O)c1ccc(cc1)c2cccnc2 CSC011399805 [1,0,0,0,0,1|2,0,0]=4 45 B16R2.85 OC(=O)c1ccc(cc1)c2ccncc2 CSC011410164 [1,0,0,0,0,1|2,0,0]=4 46 B16R2.86 OC(=O)c1cccc(c1)c2ccccc2 CSC011218927 [1,0,0,0,0,1|1,0,0]=3 47 B16R2.86 OC(=O)c1cccc(c1)c2ccccn2 CSC011894345 [1,0,0,0,0,1|2,0,0]=4 48 B16R2.86 OC(=O)c1cccc(c1)c2cccnc2 CSC011399807 [1,0,0,0,0,1|2,0,0]=4 49 B16R2.86 OC(=O)c1cccc(c1)c2ccncc2 CSC011410166 [1,0,0,0,0,1|2,0,0]=4 50 B16R2.86 OC(=O)c1cccc(n1)c2ccccc2 CSC000067463 [1,0,0,0,0,1|1,0,0]=3 51 B16R2.86 OC(=O)c1cccc(n1)c2cccnc2 CSC010234900 [1,0,0,0,0,1|2,0,0]=4 52 B16R2.86 OC(=O)c1cccc(n1)c2ccncc2 CSC010234901 [1,0,0,0,0,1|2,0,0]=4 53 B16R2.86 OC(=O)c1cncc(c1)c2ccccc2 CSC000687314 [1,0,0,0,0,1|1,0,0]=3 54 B18R2.4727 OC(=O)Cc1ccc(cc1)c2ccccc2Cl CSC000015594 [0,0,0,0,0,2|1,0,0]=3 55 B18R2.4739 NC(=O)CCc1ccc(o1)c2ccccc2F CSC046167759 [0,0,0,0,0,2|1,1,0]=4 56 B18R2.4739 OC(=O)C=Cc1ccc(s1)c2ccccc2F CSC015206659 [0,0,0,0,0,2|0,2,0]=4