0 B19R3.9162 Clc1ccccc1CN2CCc3sccc3C2 Amb534744 [0,0,0,0,0,0|0,0,0]=0 1 B19R3.9162 Clc1ccccc1CN2CCc3sccc3C2 Amb6297309 [0,0,0,0,0,0|0,0,0]=0 2 B18R3.12792 c1ccc(CN2CCc3cocc3C2)cc1 Amb22496312 [1,0,0,0,0,0|2,0,0]=3 3 B18R3.12792 c1ccc(CN2CCc3ncsc3C2)cc1 Amb21857613 [1,0,0,0,0,0|2,0,0]=3 4 B18R3.12792 c1ccc(CN2CCc3nnsc3C2)cc1 Amb2678860 [1,0,0,0,0,0|3,0,0]=4 5 B18R3.12792 c1ccc(CN2CCc3nocc3C2)cc1 Amb24184107 [1,0,0,0,0,0|2,0,0]=3 6 B18R3.12792 c1ccc(CN2CCc3sccc3C2)cc1 Amb25729077 [1,0,0,0,0,0|0,0,0]=1 7 B18R3.12792 c1ccc(CN2CCn3cncc3C2)cc1 Amb20171377 [1,0,0,0,0,0|3,0,0]=4 8 B18R3.12792 c1ccc(CN2CCn3nncc3C2)cc1 Amb31291488 [1,0,0,0,0,0|3,0,0]=4 9 B20R3.96909 O=C(c1ccncc1F)N2CCc3sccc3C2 Amb28471806 [0,1,0,0,0,0|1,1,1]=4 10 B20R3.281005 Cc1ccccc1CN2CCc3nc(N)sc3C2 Amb17042338 [0,1,0,0,0,0|3,0,0]=4 11 B20R3.281005 Nc1nc2c(s1)CN(Cc3ccccc3Cl)CC2 Amb17042344 [0,1,0,0,0,0|2,0,0]=3 12 B20R3.281005 Nc1nc2c(s1)CN(Cc3ccccc3F)CC2 Amb17042341 [0,1,0,0,0,0|2,1,0]=4 13 B18R2.6299 Cc1ccsc1CNCCc2ccccc2F Amb6352133 [0,0,1,0,0,0|2,1,0]=4 14 B18R2.20865 CCn1nccc1CNCc2ccccc2O Amb31213762 [0,0,1,0,0,0|3,0,0]=4 15 B18R3.3958 Nc1ccccc1N2CCc3sccc3C2 Amb1115393 [0,0,0,0,1,0|1,0,0]=2 16 B18R3.6238 Cc1oncc1CN2CCc3sccc3C2 Amb31199794 [0,0,0,0,1,0|3,0,0]=4 17 B20R3.13439 Nc1ccccc1CN2CCc3ccccc3C2 Amb6251396 [0,0,0,0,0,1|2,0,0]=3 18 B17R2.3430 Clc1ccccc1CNCCc2cccs2 Amb24096189 [1,0,1,0,0,0|0,0,0]=2 19 B17R2.3430 Fc1ccccc1CNCCc2nccs2 Amb17315538 [1,0,1,0,0,0|1,1,0]=4 20 B17R2.3513 Cc1ccsc1CNCCc2ccccc2 Amb1929120 [1,0,1,0,0,0|2,0,0]=4 21 B17R2.3513 Cc1ncsc1CCNCc2ccccc2 Amb27607586 [1,0,1,0,0,0|1,0,0]=3 22 B17R2.2492 C\C=C1\CN(Cc2ccccc2)CCC1=O Amb32649091 [1,0,1,0,0,0|0,1,1]=4 23 B17R2.2492 N\C=C1\CN(Cc2ccccc2)CCC1=O Amb28388688 [1,0,1,0,0,0|1,1,0]=4 24 B17R2.1085 CCn1cccc1CNCc2ccccc2 Amb19649117 [1,0,1,0,0,0|2,0,0]=4 25 B17R2.1085 CCn1nccc1CNCc2ccccc2 Amb1946010 [1,0,1,0,0,0|2,0,0]=4 26 B17R2.3945 Cc1ccsc1CNCc2ccccc2Cl Amb1929118 [1,0,1,0,0,0|2,0,0]=4 27 B17R2.3945 Cn1cccc1CNCc2ccccc2Cl Amb6465193 [1,0,1,0,0,0|2,0,0]=4 28 B19R2.49929 CN(CCc1cccs1)C(=O)c2ccccc2N Amb17267789 [0,1,1,0,0,0|1,0,1]=4 29 B19R3.256 Brc1nc2c(s1)CCN(Cc3ccccc3)C2 Amb22494917 [1,1,0,0,0,0|1,0,0]=3 30 B19R3.256 Cc1nc2c(s1)CN(Cc3ccccc3)CC2 Amb27252756 [1,1,0,0,0,0|2,0,0]=4 31 B19R3.256 Ic1nc2c(s1)CCN(Cc3ccccc3)C2 Amb27826499 [1,1,0,0,0,0|1,0,0]=3 32 B19R3.256 Ic1nc2c(s1)CN(Cc3ccccc3)CC2 Amb27957313 [1,1,0,0,0,0|2,0,0]=4 33 B19R3.256 Nc1cc2n(n1)CCN(Cc3ccccc3)C2 Amb27485966 [1,1,0,0,0,0|2,0,0]=4 34 B19R3.256 Nc1nc2c(s1)CCN(Cc3ccccc3)C2 Amb9183606 [1,1,0,0,0,0|1,0,0]=3 35 B19R3.256 Nc1nc2c(s1)CN(Cc3ccccc3)CC2 Amb1103891 [1,1,0,0,0,0|2,0,0]=4 36 B19R3.256 Sc1nc2c(s1)CN(Cc3ccccc3)CC2 Amb27463845 [1,1,0,0,0,0|2,0,0]=4 37 B19R3.5798 Cn1cnc2c1CCN(Cc3ccccc3)C2 Amb33624133 [1,1,0,0,0,0|2,0,0]=4 38 B19R3.5798 Nc1csc2c1CCN(Cc3ccccc3)C2 Amb27461278 [1,1,0,0,0,0|2,0,0]=4 39 B19R3.9172 NC1CN(Cc2ccccc2)Cc3sccc31 Amb18721449 [1,1,0,0,0,0|2,0,0]=4 40 B19R3.13090 Nc1ccc(CN2CCc3ncsc3C2)cc1 Amb17307529 [1,1,0,0,0,0|2,0,0]=4 41 B19R3.89397 Oc1onc2c1CN(Cc3ccccc3)CC2 Amb27427402 [1,1,0,0,0,0|2,0,0]=4 42 B19R3.182323 Nc1cccc(CN2CCc3ncsc3C2)c1 Amb17307530 [1,1,0,0,0,0|2,0,0]=4 43 B19R3.185300 Nc1ccc(N2CCc3sccc3C2)c(F)c1 Amb9207809 [0,1,0,0,1,0|0,1,0]=3 44 B19R3.171085 Cc1ccccc1CN2Cc3nc(N)sc3C2 Amb17519221 [0,1,0,0,1,0|2,0,0]=4 45 B21R3.36992 N#Cc1ccccc1CN2CCc3ccccc3C2 Amb6663916 [0,1,0,0,0,1|2,0,0]=4 46 B21R3.36992 NCc1ccccc1CN2CCc3ccccc3C2 Amb1139280 [0,1,0,0,0,1|2,0,0]=4 47 B21R3.153046 Cc1ccccc1CN2CCc3ccc(N)cc3C2 Amb17161544 [0,1,0,0,0,1|2,0,0]=4 48 B21R3.153046 Nc1ccc2c(c1)CN(Cc3ccccc3Cl)CC2 Amb17167868 [0,1,0,0,0,1|1,0,0]=3 49 B21R3.153046 Nc1ccc2c(c1)CN(Cc3ccccc3F)CC2 Amb17162416 [0,1,0,0,0,1|1,1,0]=4 50 B21R3.159209 O=C(c1ccccc1Cl)N2CCc3ncncc3C2 Amb22706294 [0,1,0,0,0,1|1,0,1]=4 51 B21R3.468597 Cc1c(N)cccc1CN2CCc3ccccc3C2 Amb9369609 [0,1,0,0,0,1|2,0,0]=4 52 B21R3.476351 Nc1ccc(CN2CCc3ccccc3C2)c(Cl)c1 Amb17050792 [0,1,0,0,0,1|1,0,0]=3 53 B21R3.476426 Cc1ccc(N)cc1CN2CCc3ccccc3C2 Amb17413845 [0,1,0,0,0,1|2,0,0]=4 54 B21R3.476426 Nc1ccc(Cl)c(CN2CCc3ccccc3C2)c1 Amb9003455 [0,1,0,0,0,1|1,0,0]=3 55 B21R3.159624 O=C(Cc1ccccc1Cl)N2CCn3nccc3C2 Amb28474675 [0,1,0,0,0,1|2,0,0]=4 56 B21R3.470043 Cc1c(N)cccc1C(=O)N2CCc3sccc3C2 Amb1111819 [0,2,0,0,0,0|1,0,1]=4 57 B21R3.4483118 Nc1nc2c(s1)CN(Cc3c(F)cccc3Cl)CC2 Amb17042349 [0,2,0,0,0,0|2,0,0]=4 58 B17R3.1941 c1cnc(N2CCc3sccc3C2)cn1 Amb28469541 [1,0,0,0,1,0|2,0,0]=4 59 B19R2.47945 Nc1cccc(CCNCc2ccccc2Cl)c1 Amb18550431 [0,0,1,0,0,1|2,0,0]=4 60 B19R2.29003 COc1ccccc1CNCc2ccccc2Cl Amb838370 [0,0,1,0,0,1|2,0,0]=4 61 B19R2.191434 COc1cccc(CNCc2ccccc2Cl)c1 Amb6457905 [0,0,1,0,0,1|2,0,0]=4 62 B19R2.9895 CCN(Cc1ccccc1)Cc2ccccc2N Amb7787913 [0,0,1,0,0,1|2,0,0]=4 63 B19R2.9895 CCN(Cc1ccccc1)Cc2ccccc2O Amb10815874 [0,0,1,0,0,1|2,0,0]=4 64 B19R3.19215 c1ccc(CN2CCc3cnccc3C2)cc1 Amb22753247 [1,0,0,0,0,1|1,0,0]=3 65 B19R3.19215 c1ccc(CN2CCc3cncnc3C2)cc1 Amb24332310 [1,0,0,0,0,1|2,0,0]=4 66 B19R3.19215 c1ccc(CN2CCc3ncccc3C2)cc1 Amb21858379 [1,0,0,0,0,1|1,0,0]=3 67 B19R3.19215 c1cncc(CN2CCc3ccccc3C2)c1 Amb31195017 [1,0,0,0,0,1|2,0,0]=4 68 B19R3.1761481 c1ccc(CN2CCc3ccsc3CC2)cc1 Amb27978527 [1,0,0,0,0,1|0,0,0]=2 69 B19R3.5517 Nc1ccccc1N2CCc3ccccc3C2 Amb1110296 [0,0,0,0,1,1|2,0,0]=4 70 B21R3.218733 Nc1ccccc1CCN2CCc3ccccc3C2 Amb5733563 [0,0,0,0,0,2|2,0,0]=4