0 B25R3.362531453 COc1cc(c(cc1Br)F)C=C(C#N)c2nc3ccccc3s2 6a_100000695681_100000183664 [0,0,0,0,0,0|2,1,0]=3 1 B25R3.362531453 COc1cc(c(cc1Cl)F)C=C(C#N)c2nc3ccccc3s2 6a_100000050388_100000183664 [0,0,0,0,0,0|2,1,0]=3 2 B25R3.362531453 COc1cc(c(cc1F)Br)C=C(C#N)c2nc3ccccc3s2 6a_100010366953_100000183664 [0,0,0,0,0,0|2,0,0]=2 3 B25R3.362531453 COc1cc(c(cc1F)F)C=C(C#N)c2nc3ccccc3s2 6a_100010630602_100000183664 [0,0,0,0,0,0|2,1,0]=3 4 B24R3.7480849 COc1ccc(c(c1)C=C(C#N)c2nc3ccccc3s2)F 6a_100000034340_100000183664 [1,0,0,0,0,0|1,1,0]=3 5 B24R3.7480849 COc1ccc(c(c1)C=C(C#N)c2nc3ccccc3s2)I 6a_100010075557_100000183664 [1,0,0,0,0,0|1,1,0]=3 6 B24R3.69769831 COc1cc(ccc1C)C=C(C#N)c2nc3ccccc3s2 6a_100000719150_100000183664 [1,0,0,0,0,0|2,0,0]=3 7 B24R3.69769831 COc1cc(ccc1Cl)C=C(C#N)c2nc3ccccc3s2 6a_100011998524_100000183664 [1,0,0,0,0,0|2,0,0]=3 8 B24R3.69769831 COc1cc(ccc1F)C=C(C#N)c2nc3ccccc3s2 6a_100000692873_100000183664 [1,0,0,0,0,0|2,0,0]=3 9 B24R3.269374541 Cc1cc(c(cc1Br)F)C=C(C#N)c2nc3ccccc3s2 6a_100010186291_100000183664 [1,0,0,0,0,0|2,1,0]=4 10 B24R3.269374541 Cc1cc(c(cc1C)C=C(C#N)c2nc3ccccc3s2)I 6a_100010184403_100000183664 [1,0,0,0,0,0|2,1,0]=4 11 B24R3.269374541 Cc1cc(c(cc1Cl)F)C=C(C#N)c2nc3ccccc3s2 6a_100015641705_100000183664 [1,0,0,0,0,0|2,1,0]=4 12 B24R3.269374541 Cc1cc(c(cc1F)Br)C=C(C#N)c2nc3ccccc3s2 6a_100009814814_100000183664 [1,0,0,0,0,0|2,0,0]=3 13 B24R3.269374541 Cc1cc(c(cc1F)C=C(C#N)c2nc3ccccc3s2)Br 6a_100010186290_100000183664 [1,0,0,0,0,0|3,0,0]=4 14 B24R3.269374541 Cc1cc(c(cc1F)F)C=C(C#N)c2nc3ccccc3s2 6a_100012017330_100000183664 [1,0,0,0,0,0|2,1,0]=4 15 B24R3.269374541 N#CC(=Cc1cc(c(cc1Br)Cl)F)c2nc3ccccc3s2 6a_100010270164_100000183664 [1,0,0,0,0,0|3,0,0]=4 16 B24R3.269374541 N#CC(=Cc1cc(c(cc1Br)F)F)c2nc3ccccc3s2 6a_100012344232_100000183664 [1,0,0,0,0,0|3,0,0]=4 17 B24R3.269374541 N#CC(=Cc1cc(c(cc1F)O)Cl)c2nc3ccccc3s2 6a_100000700858_100000183664 [1,0,0,0,0,0|2,1,0]=4 18 B24R3.269374541 N#CC(=Cc1cc(c(cc1F)O)F)c2nc3ccccc3s2 6a_200000061741_100000183664 [1,0,0,0,0,0|2,1,0]=4 19 B26R3.67008465 COc1cc(c(cc1OC)C=C(C#N)c2nc3ccccc3s2)F 6a_100011218750_100000183664 [0,1,0,0,0,0|1,1,0]=3 20 B26R3.67008465 COc1cc(c(cc1OC)C=C(C#N)c2nc3ccccc3s2)I 6a_100010174930_100000183664 [0,1,0,0,0,0|1,1,0]=3 21 B26R3.135762767 COc1c(cc(c(c1F)C=C(C#N)c2nc3ccccc3s2)F)F 6a_100000084228_100000183664 [0,1,0,0,0,0|2,1,0]=4 22 B26R3.427708721 COc1cc(c(cc1Cl)OC)C=C(C#N)c2nc3ccccc3s2 6a_100010168916_100000183664 [0,1,0,0,0,0|3,0,0]=4 23 B26R3.427708721 COc1cc(c(cc1I)OC)C=C(C#N)c2nc3ccccc3s2 6a_200010262236_100000183664 [0,1,0,0,0,0|3,0,0]=4 24 B24R2.20542142 COc1cc(c(cc1F)Br)C=C(C#N)CNc2ccccc2F 6a_100010366953_100000182403 [0,0,1,0,0,0|2,0,1]=4 25 B26R4.163491530 N#CC(=Cc1cc2c(cc1Br)OCO2)c3nc4ccccc4s3 6a_100000186749_100000183664 [0,0,0,1,0,0|1,0,0]=2 26 B26R4.163491530 N#CC(=Cc1cc2c(cc1Cl)OCO2)c3nc4ccccc4s3 6a_100000015535_100000183664 [0,0,0,1,0,0|1,1,0]=3 27 B26R4.163491530 N#CC(=Cc1cc2c(cc1O)OCO2)c3nc4ccccc4s3 6a_200000055047_100000183664 [0,0,0,1,0,0|2,0,0]=3 28 B26R3.67036809 COc1cc(c(cc1F)Br)C=C(C#N)c2ccc3ccccc3c2 6a_100010366953_100011215304 [0,0,0,0,0,1|3,0,0]=4 29 B23R2.67355 COc1cc(ccc1O)C=C(C#N)C(=O)Cc2ccccc2 1458a_100000162688_100015291786 [1,0,1,0,0,0|2,0,0]=4 30 B23R2.67355 COc1cc(ccc1O)C=C(C#N)C(=O)Nc2ccccc2 22a_100000106764_100000162688 [1,0,1,0,0,0|1,0,0]=3 31 B23R3.20672104 Cc1ccc(c(c1)C=C(C#N)c2nc3ccccc3s2)F 6a_100000756917_100000183664 [2,0,0,0,0,0|1,1,0]=4 32 B23R3.20672104 Cc1ccc(c(c1)C=C(C#N)c2nc3ccccc3s2)I 6a_100010150105_100000183664 [2,0,0,0,0,0|1,1,0]=4 33 B23R3.20672104 N#CC(=Cc1cc(ccc1Br)I)c2nc3ccccc3s2 6a_100010185652_100000183664 [2,0,0,0,0,0|2,0,0]=4 34 B23R3.20672104 N#CC(=Cc1cc(ccc1I)O)c2nc3ccccc3s2 6a_100000069132_100000183664 [2,0,0,0,0,0|1,1,0]=4 35 B23R3.20792141 Cc1cc(ccc1Cl)C=C(C#N)c2nc3ccccc3s2 6a_100000698814_100000183664 [2,0,0,0,0,0|2,0,0]=4 36 B23R3.20792141 Cc1cc(ccc1F)C=C(C#N)c2nc3ccccc3s2 6a_100000748208_100000183664 [2,0,0,0,0,0|2,0,0]=4 37 B23R3.20792141 Cc1ccc(cc1C)C=C(C#N)c2nc3ccccc3s2 6a_100000229942_100000183664 [2,0,0,0,0,0|2,0,0]=4 38 B23R3.20792141 N#CC(=Cc1ccc(c(c1)Cl)O)c2nc3ccccc3s2 6a_100000186751_100000183664 [2,0,0,0,0,0|2,0,0]=4 39 B23R3.20792141 N#CC(=Cc1ccc(c(c1)F)O)c2nc3ccccc3s2 6a_100000742332_100000183664 [2,0,0,0,0,0|2,0,0]=4 40 B23R3.20792141 N#CC(=Cc1ccc(c(c1)I)O)c2nc3ccccc3s2 6a_100000186752_100000183664 [2,0,0,0,0,0|2,0,0]=4 41 B23R3.20792141 N#CC(=Cc1ccc(c(c1)O)Cl)c2nc3ccccc3s2 6a_100009876013_100000183664 [2,0,0,0,0,0|2,0,0]=4 42 B23R3.20792141 N#CC(=Cc1ccc(c(c1)O)F)c2nc3ccccc3s2 6a_100000102368_100000183664 [2,0,0,0,0,0|2,0,0]=4 43 B23R3.20792141 N#CC(=Cc1ccc(c(c1)O)I)c2nc3ccccc3s2 6a_100000041418_100000183664 [2,0,0,0,0,0|2,0,0]=4 44 B23R3.42422079 N#CC(=Cc1ccc(cc1Br)I)c2nc3ccccc3s2 6a_100010185650_100000183664 [2,0,0,0,0,0|2,0,0]=4 45 B23R3.42422079 N#CC(=Cc1ccc(cc1I)O)c2nc3ccccc3s2 6a_100000051608_100000183664 [2,0,0,0,0,0|1,1,0]=4 46 B25R2.28774726 COc1cc(c(cc1F)Br)C=C(C#N)C(=O)Nc2cccc(c2)F 6a_100010366953_100011203524 [0,1,1,0,0,0|2,0,0]=4 47 B25R3.55164384 COc1ccc(c(c1F)C=C(C#N)c2nc3ccccc3s2)F 6a_100000062052_100000183664 [1,1,0,0,0,0|1,1,0]=4 48 B25R3.11839327 COc1c(ccc(c1F)C=C(C#N)c2nc3ccccc3s2)Cl 6a_100009889114_100000183664 [1,1,0,0,0,0|2,0,0]=4 49 B25R3.11839327 COc1c(ccc(c1F)C=C(C#N)c2nc3ccccc3s2)F 6a_100000050928_100000183664 [1,1,0,0,0,0|2,0,0]=4 50 B25R3.221455814 COc1cc(cc(c1F)F)C=C(C#N)c2nc3ccccc3s2 6a_100000050682_100000183664 [1,1,0,0,0,0|2,0,0]=4 51 B25R3.221455814 COc1cc(cc(c1O)Br)C=C(C#N)c2nc3ccccc3s2 6a_100000186746_100000183664 [1,1,0,0,0,0|1,0,0]=3 52 B25R3.221455814 COc1cc(cc(c1O)C)C=C(C#N)c2nc3ccccc3s2 6a_100000050991_100000183664 [1,1,0,0,0,0|1,0,0]=3 53 B25R3.221455814 COc1cc(cc(c1O)Cl)C=C(C#N)c2nc3ccccc3s2 6a_100000010622_100000183664 [1,1,0,0,0,0|1,0,0]=3 54 B25R3.221455814 COc1cc(cc(c1O)F)C=C(C#N)c2nc3ccccc3s2 6a_100000039941_100000183664 [1,1,0,0,0,0|1,0,0]=3 55 B25R3.221455814 COc1cc(cc(c1O)I)C=C(C#N)c2nc3ccccc3s2 6a_100000184534_100000183664 [1,1,0,0,0,0|1,0,0]=3 56 B25R3.237464249 CCOc1cc(ccc1F)C=C(C#N)c2nc3ccccc3s2 6a_200000106648_100000183664 [1,1,0,0,0,0|2,0,0]=4 57 B27R3.74637261 COc1cc(c(cc1OC)CC(=Cc2nc3ccccc3s2)C#N)Br 6a_100011204187_100009992945 [0,1,0,0,0,1|1,0,1]=4 58 B27R3.444566514 COc1cc(c(cc1OC)C=C(C#N)c2nc3ccccc3s2)C#N 6a_100013041662_100000183664 [0,2,0,0,0,0|2,0,0]=4 59 B25R3.12429736 N#CC(=Cc1cc2c(cc1Br)OCO2)CNc3ccccc3F 6a_100000186749_100000182403 [0,0,1,1,0,0|1,0,1]=4 60 B25R4.56890355 N#CC(=Cc1ccc2c(c1)CCO2)c3nc4ccccc4s3 6a_100011218456_100000183664 [1,0,0,1,0,0|2,0,0]=4 61 B27R4.32811607 N#CC(=Cc1cc2c(cc1Br)OCO2)c3ccc4ccccc4c3 6a_100000186749_100011215304 [0,0,0,1,0,1|2,0,0]=4 62 B27R4.220275291 Cc1cc2c(cc1C=C(C#N)c3nc4ccccc4s3)OCCO2 6a_100000101720_100000183664 [0,1,0,1,0,0|2,0,0]=4 63 B27R4.41898857 COc1cc2c(cc1C=C(C#N)c3nc4ccccc4s3)OCO2 6a_100000186743_100000183664 [0,1,0,1,0,0|2,0,0]=4 64 B25R3.54497484 COc1cc(c(cc1O)Br)CC(=O)Cc2nc3ccccc3[nH]2 1458a_100009814189_100000737899 [1,0,0,0,0,1|1,0,1]=4 65 B25R3.103861773 COc1c(cc(cc1C=C(C#N)c2nc3ccccc3s2)Br)Br 6a_200000180144_100000183664 [0,0,0,0,1,1|2,0,0]=4