0 B21R3.57 C1=C(CCCO1)c2ccccc2Cc3ccccc3 271570a_100010175576_200011216382 [1,0,1,0,0,0|2,0,0]=4 1 B21R3.57 C1=C(CCNC1)c2ccccc2Cc3ccccc3 271570a_100000731432_200011216382 [1,0,1,0,0,0|0,0,0]=2 2 B21R3.57 C1=C(CCNC1)c2ccccc2Oc3ccccc3 271570a_100000731432_100000049502 [1,0,1,0,0,0|1,0,0]=3 3 B21R3.57 C1=C(CCOC1)c2ccccc2Cc3ccccc3 271570a_100000070234_200011216382 [1,0,1,0,0,0|1,0,0]=3 4 B21R3.57 C1=C(CCOC1)c2ccccc2Oc3ccccc3 271570a_100000070234_100000049502 [1,0,1,0,0,0|2,0,0]=4 5 B21R3.57 C1=C(CCSC1)c2ccccc2Cc3ccccc3 271570a_100010232141_200011216382 [1,0,1,0,0,0|1,0,0]=3 6 B21R3.57 C1=C(OCCC1)c2ccccc2Cc3ccccc3 271570a_100010177797_200011216382 [1,0,1,0,0,0|2,0,0]=4 7 B21R3.7866160 CN(C)CC1=Nc2ccccc2Cc3c1cccc3 2230a_100102631434_200015227246 [1,0,1,0,0,0|1,0,0]=3 8 B21R3.648368 CCNCC1=Nc2ccccc2Cc3c1cccc3 2230a_100015525214_200015227246 [1,0,1,0,0,0|1,0,0]=3 9 B21R3.648368 CCSCC1=Nc2ccccc2Cc3c1cccc3 62a_200015227246_100000210202 [1,0,1,0,0,0|2,0,0]=4 10 B21R3.805 CC1CC=C(CC1)c2ccccc2c3ccccn3 271570a_100010240233_100010202516 [0,0,1,0,1,0|2,0,0]=4 11 B21R3.805 CC1CC=C(CC1)c2ccccc2c3ccncc3 271570a_100010240233_100010154595 [0,0,1,0,1,0|2,0,0]=4 12 B21R3.805 CC1CC=C(CC1)c2cccnc2c3ccccc3 271570a_100010240233_100010138707 [0,0,1,0,1,0|2,0,0]=4 13 B21R3.805 CC1CC=C(CC1)c2cnccc2c3ccccc3 271570a_100010240233_100009816686 [0,0,1,0,1,0|2,0,0]=4 14 B21R3.805 CN1CCN(CC1)c2ccccc2c3ccccc3 2230a_100020605234_200000210301 [0,0,1,0,1,0|1,0,1]=4 15 B21R3.805 CN1CCN(CC1)c2ccccc2c3ccccc3 269982a_100020605234_200000210301 [0,0,1,0,1,0|1,0,1]=4 16 B21R3.805 CN1CCN(CC1)c2ccccc2c3ccccc3 271570a_200010725140_100000210277 [0,0,1,0,1,0|1,0,1]=4 17 B21R3.805 OC1CC=C(CC1)c2ccccc2c3ccccc3 271570a_100010254553_100000033479 [0,0,1,0,1,0|2,0,0]=4 18 B21R3.805 [13CH3]N1CCN(CC1)c2ccccc2c3ccccc3 2230a_100020605234_200025704644 [0,0,1,0,1,0|1,0,1]=4 19 B21R3.805 [13CH3]N1CCN(CC1)c2ccccc2c3ccccc3 269982a_100020605234_200025704644 [0,0,1,0,1,0|1,0,1]=4 20 B21R3.7476 Cn1cc(cn1)c2ccccc2Cc3ccccc3 271570a_100000685319_200011216382 [0,0,1,0,1,0|1,0,1]=4 21 B21R3.7476 Cn1cc(cn1)c2ccccc2Cc3ccccc3 271570a_100000766508_100000748075 [0,0,1,0,1,0|1,0,1]=4 22 B21R3.7476 Cn1cc(nn1)c2ccccc2Cc3ccccc3 271570a_100000766508_100000760339 [0,0,1,0,1,0|2,0,0]=4 23 B21R3.7476 Cn1ccc(c1)c2ccccc2Cc3ccccc3 271570a_100010172022_200011216382 [0,0,1,0,1,0|0,0,2]=4 24 B21R3.7476 Cn1ccc(n1)c2ccccc2Cc3ccccc3 271570a_100000766508_100000752436 [0,0,1,0,1,0|1,0,1]=4 25 B21R3.7476 Cn1ccc(n1)c2ccccc2Cc3ccccc3 271570a_100012348833_200011216382 [0,0,1,0,1,0|1,0,1]=4 26 B21R3.7476 Cn1cnc(c1)c2ccccc2Cc3ccccc3 271570a_100000766508_100000040308 [0,0,1,0,1,0|1,0,1]=4 27 B21R3.7476 Cn1ncc(n1)c2ccccc2Cc3ccccc3 271570a_100000766508_100000733932 [0,0,1,0,1,0|2,0,0]=4 28 B21R3.7476 O=C1C=C(CC1)c2ccccc2Cc3ccccc3 271570a_100010737933_200011216382 [0,0,1,0,1,0|2,0,0]=4 29 B21R3.11786 Cn1cccc1c2ccccc2Cc3ccccc3 271570a_100000068268_200011216382 [0,0,1,0,1,0|0,0,2]=4 30 B21R3.11786 Cn1cncc1c2ccccc2Cc3ccccc3 271570a_100000766508_100009814087 [0,0,1,0,1,0|1,0,1]=4 31 B21R3.11786 Cn1cncc1c2ccccc2Cc3ccccc3 271570a_100009892668_200011216382 [0,0,1,0,1,0|1,0,1]=4 32 B21R3.11786 Cn1nccc1c2ccccc2Cc3ccccc3 271570a_100000707534_200011216382 [0,0,1,0,1,0|1,0,1]=4 33 B21R3.11786 Cn1nccc1c2ccccc2Cc3ccccc3 271570a_100000766508_100000688441 [0,0,1,0,1,0|1,0,1]=4 34 B21R3.355 Cc1ccccc1c2cn(nc2c3ccccc3)C 271570a_100000747142_200010162547 [0,0,1,0,1,0|1,0,1]=4 35 B21R3.355 Cc1ccccc1c2cn(nc2c3ccccc3)C 271570a_100010074876_100000210755 [0,0,1,0,1,0|1,0,1]=4 36 B21R3.12218 Cc1ccccc1c2cnn(c2c3ccccc3)C 271570a_100000747142_100009814052 [0,0,1,0,1,0|1,0,1]=4 37 B21R3.12218 Cc1ccccc1c2cnn(c2c3ccccc3)C 271570a_100011080732_100000210755 [0,0,1,0,1,0|1,0,1]=4 38 B21R3.9759201 CCN(C)Cc1c2ccccc2cc3c1cccc3 2230a_100000010331_100000210202 [0,0,1,0,1,0|0,0,1]=3 39 B21R3.9759201 CCN(C)Cc1c2ccccc2cc3c1cccc3 2230a_100000225621_100009992879 [0,0,1,0,1,0|0,0,1]=3 40 B21R3.9759201 CCN(C)Cc1c2ccccc2cc3c1cccc3 269982a_100000010331_100000204670 [0,0,1,0,1,0|0,0,1]=3 41 B21R3.9759201 CCN(C)Cc1c2ccccc2cc3c1cccc3 269982a_100000225621_100009992879 [0,0,1,0,1,0|0,0,1]=3 42 B21R3.9759201 CCN(C)Cc1c2ccccc2nc3c1cccc3 2230a_100000225621_100009813545 [0,0,1,0,1,0|1,0,0]=3 43 B21R3.9759201 CN(CF)Cc1c2ccccc2cc3c1cccc3 269982a_100000010331_100015361967 [0,0,1,0,1,0|1,0,1]=4 44 B21R3.7888781 CC(C)NCc1cc2ccccc2c3c1cccc3 207a_100138425928_100000033530 [0,0,1,0,1,0|2,0,0]=4