0 B19R2.13577 CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2 PH010134 [0,0,0,0,0,0|0,0,0]=0 1 B19R2.13577 CN(C)CCN(C1=CC=CC=C1)C2=CC=CC=C2 PH011960 [0,0,0,0,0,0|2,0,0]=2 2 B19R2.13577 O=C(O)CCC(C1=CC=CC=C1)C2=CC=CC=C2 T137472 [0,0,0,0,0,0|4,0,0]=4 3 B19R2.13577 O=C(O)CCC(C1=CC=CC=C1)C2=NC=CC=C2 PH007473 [0,0,0,0,0,0|3,0,0]=3 4 B18R2.40 CCCCC(C1=CC=CC=C1)C2=CC=CC=C2 S831964 [1,0,0,0,0,0|2,0,0]=3 5 B18R2.40 CCCCC(C1=CC=CC=C1)C2=CC=CC=C2 T181358 [1,0,0,0,0,0|2,0,0]=3 6 B18R2.40 CCCCC(C1=CC=CC=C1)C2=CC=CC=N2 S593710 [1,0,0,0,0,0|1,0,0]=2 7 B18R2.40 CCCOC(C1=CC=CC=C1)C2=CC=CC=C2 S706086 [1,0,0,0,0,0|3,0,0]=4 8 B18R2.40 NCCCC(C1=CC=CC=C1)C2=CN=CC=N2 PH013193 [1,0,0,0,0,0|3,0,0]=4 9 B20R2.240825 CN(C)CCC(C1=CC=C(C=C1)Br)C2=NC=CC=C2 PH006807 [0,1,0,0,0,0|0,0,0]=1 10 B20R3.8612 CN1CC(=C(C2=CC=CC=C2)C3=CC=CC=C3)C1 PH008128 [0,0,0,1,0,0|1,0,2]=4 11 B20R3.27675 CN1CCC(C1)(C2=CC=CC=C2)C3=CC=CC=C3 PH012229 [0,0,0,1,0,0|1,0,0]=2 12 B20R3.651490 CN(C)CCN1C2=CC=CC=C2C3=C1C=CC=C3 PH011959 [0,0,0,1,0,0|2,0,0]=3 13 B20R3.651490 CN(C)CCN1C2=CC=CC=C2C3=C1N=CN=C3 PH013815 [0,0,0,1,0,0|2,0,0]=3 14 B20R3.5050813 CN(C)N1CC(C2=CC=CC=C12)C3=CC=CC=C3 PH001141 [0,0,0,1,0,0|2,0,0]=3 15 B18R2.7184 CC(N)CC(C1=CC=CC=C1)C2=CC=CC=C2 PH011962 [0,0,0,0,1,0|3,0,0]=4 16 B20R2.10559 CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=C2 S341819 [0,0,0,0,0,1|2,0,0]=3 17 B20R2.10559 CN(C)CCN(CC1=CC=CC=C1)C2=NC=CC=C2 R288918 [0,0,0,0,0,1|1,0,0]=2 18 B20R2.10799 CN(C)CCCN(C1=CC=CC=C1)C2=CC=CC=C2 PH012175 [0,0,0,0,0,1|2,0,0]=3 19 B19R2.2474 CCCNCC(C1=CC=CC=C1)C2=CC=CC=C2 PH014122 [1,1,0,0,0,0|2,0,0]=4 20 B19R2.2474 CNCCOC(C1=CC=CC=C1)C2=CC=CC=C2 CDS010175 [1,1,0,0,0,0|1,0,0]=3 21 B19R2.13225 CNCCC(O)(C1=CC=CC=C1)C2=CC=CC=C2 S877506 [1,1,0,0,0,0|1,0,0]=3 22 B19R2.13518 CN(C)CC(O)(C1=CC=CC=C1)C2=CC=CC=C2 PH012127 [0,1,0,0,1,0|1,0,0]=3 23 B19R2.13518 CS(=O)CC(O)(C1=CC=CC=C1)C2=NC=CC=C2 PH005689 [0,1,0,0,1,0|2,0,0]=4 24 B21R2.358766 CN(C)CCN(CC1=CC=C(C=C1)Cl)C2=CC=CC=N2 S424153 [0,1,0,0,0,1|1,0,0]=3 25 B21R2.103739 CN(C)CCSC(C1=CC=CC=C1)C2=CC=CC(=C2)Cl PH011935 [0,1,0,0,0,1|1,0,0]=3 26 B21R2.205989 CC1=CC=CC=C1C(SCCN(C)C)C2=CC=CC=C2 PH011957 [0,1,0,0,0,1|1,0,0]=3 27 B21R2.205989 CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2Br PH012032 [0,1,0,0,0,1|1,0,0]=3 28 B21R2.205989 CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2Cl PH011882 [0,1,0,0,0,1|1,0,0]=3 29 B21R2.205989 CN(C)CCSC(C1=CC=CC=C1)C2=CC=CC=C2Cl PH011913 [0,1,0,0,0,1|1,0,0]=3 30 B21R2.366996 CC1=CC=C(C=C1)C(OCCN(C)C)C2=CC=CC=C2 PH011874 [0,1,0,0,0,1|1,0,0]=3 31 B21R2.366996 CN(C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)F PH011896 [0,1,0,0,0,1|1,0,0]=3 32 B21R2.541 CCOC(=O)CCC(C1=CC=CC=C1)C2=NC=CC=C2 PH001435 [0,2,0,0,0,0|2,0,0]=4 33 B21R2.3566632 CN(C)CCC(O)(C1=CC=CC=C1)C2=CC=CC=C2Cl PH010350 [0,2,0,0,0,0|1,0,0]=3 34 B19R3.9008 CN1CCC(C2=CC=CC=C12)C3=CC=CC=C3 PH007516 [1,0,0,1,0,0|1,0,0]=3 35 B19R3.9008 O=C1CCC(C2=CC=CC=C12)C3=CC=CC=N3 PH012979 [1,0,0,1,0,0|2,0,0]=4 36 B19R3.19319 C1=CC=C(C=C1)C(C2=CC=CC=C2)C3CSC3 T165484 [1,0,0,1,0,0|2,0,0]=4 37 B21R3.7545 CN1CCC(=C(C2=CC=CC=C2)C3=CC=CC=C3)C1 PH008059 [0,0,0,1,0,1|1,0,1]=4 38 B21R3.9913503 CN(C)CCCN1C2=CC=CC=C2C3=C1C=CC=C3 PH013580 [0,0,0,1,0,1|2,0,0]=4 39 B21R3.9913503 CN(C)CCNC1C2=C(C=CC=C2)C3=C1C=CC=C3 S683302 [0,0,0,1,0,1|1,0,0]=3 40 B21R3.808 CN1CCC(OC1)(C2=CC=CC=C2)C3=CC=CC=C3 PH011963 [0,1,0,1,0,0|1,0,0]=3 41 B21R3.808 O=C1CCC(CN1)(C2=CC=CC=C2)C3=NC=CC=C3 PH005607 [0,1,0,1,0,0|2,0,0]=4 42 B17R2.5711 CC(C)C(C1=CC=CC=C1)C2=CC=CC=C2 S886521 [0,0,0,0,2,0|2,0,0]=4 43 B17R2.5711 CN(C)C(C1=CC=CC=C1)C2=CC=CC=C2 S888656 [0,0,0,0,2,0|1,0,0]=3 44 B19R2.2540 CN(C)CC(OC1=CC=CC=C1)C2=CC=CC=C2 PH012563 [0,0,0,0,1,1|1,0,0]=3 45 B21R2.12899 CN(C)CCCN(CC1=CC=CC=C1)C2=CC=CC=C2 PH013901 [0,0,0,0,0,2|2,0,0]=4 46 B21R2.12898 CC(C)NCCOC(C1=CC=CC=C1)C2=CC=CC=C2 PH011933 [0,0,0,0,0,2|2,0,0]=4