0 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1cccc2c1cccc2 62a_100011261445_100016277853 [0,0,0,0,0,0|1,0,0]=1 1 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1cccc2c1cccc2 62a_100016277853_100000188474 [0,0,0,0,0,0|1,0,0]=1 2 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1cccc2c1ccnc2 62a_100016277853_100016989825 [0,0,0,0,0,0|2,0,0]=2 3 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1cccc2c1ccnc2 62a_100016989825_100016277853 [0,0,0,0,0,0|2,0,0]=2 4 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1cccc2c1nccc2 62a_100016277853_100000241032 [0,0,0,0,0,0|2,0,0]=2 5 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1ccnc2c1cccc2 62a_100015192512_100016277853 [0,0,0,0,0,0|2,0,0]=2 6 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1ccnc2c1cccc2 62a_100016277853_100015192512 [0,0,0,0,0,0|2,0,0]=2 7 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1nccc2c1cccc2 62a_100000033776_100016277853 [0,0,0,0,0,0|2,0,0]=2 8 B22R2.95511992 CC(C)(C)C#C/C=C/CSCc1nccc2c1cccc2 62a_100016277853_100000033776 [0,0,0,0,0,0|2,0,0]=2 9 B22R2.95511992 CC(C)(C)C#CC=CCSCc1cccc2c1cccc2 62a_100000008102_100000188474 [0,0,0,0,0,0|1,0,0]=1 10 B22R2.95511992 CC(C)(C)C#CC=CCSCc1cccc2c1cccc2 62a_100011261445_100000008102 [0,0,0,0,0,0|1,0,0]=1 11 B22R2.95511992 CC(C)(C)C#CC=CCSCc1cccc2c1ccnc2 62a_100000008102_100016989825 [0,0,0,0,0,0|2,0,0]=2 12 B22R2.95511992 CC(C)(C)C#CC=CCSCc1cccc2c1ccnc2 62a_100016989825_100000008102 [0,0,0,0,0,0|2,0,0]=2 13 B22R2.95511992 CC(C)(C)C#CC=CCSCc1cccc2c1nccc2 62a_100000008102_100000241032 [0,0,0,0,0,0|2,0,0]=2 14 B22R2.95511992 CC(C)(C)C#CC=CCSCc1ccnc2c1cccc2 62a_100000008102_100015192512 [0,0,0,0,0,0|2,0,0]=2 15 B22R2.95511992 CC(C)(C)C#CC=CCSCc1ccnc2c1cccc2 62a_100015192512_100000008102 [0,0,0,0,0,0|2,0,0]=2 16 B22R2.95511992 CC(C)(C)C#CC=CCSCc1nccc2c1cccc2 62a_100000008102_100000033776 [0,0,0,0,0,0|2,0,0]=2 17 B22R2.95511992 CC(C)(C)C#CC=CCSCc1nccc2c1cccc2 62a_100000033776_100000008102 [0,0,0,0,0,0|2,0,0]=2 18 B22R2.95511992 C[Si](C)(C)C#CCCCOCc1cccc2c1cccc2 34a_100011216843_200000066390 [0,0,0,0,0,0|1,1,2]=4 19 B22R2.95511992 C[Si](C)(C)C#CCCCOCc1cccc2c1cccc2 7a_100000065854_100011261445 [0,0,0,0,0,0|1,1,2]=4 20 B22R2.95511992 C[Si](C)(C)C#CCCCOCc1cccc2c1cccc2 7a_100011216843_200000066390 [0,0,0,0,0,0|1,1,2]=4 21 B22R2.95511992 C[Si](C)(C)C#CCCCSCc1cccc2c1cccc2 62a_100011261445_200000066390 [0,0,0,0,0,0|1,1,2]=4 22 B22R2.95511992 C[Si](C)(C)C#CCCCSCc1cccc2c1cccc2 62a_200000066390_100000188474 [0,0,0,0,0,0|1,1,2]=4 23 B23R2.377218 CC(C)(C)C#C/C=C/CSCc1cc(nc2c1cccc2)Cl 62a_100016277853_200010137201 [0,1,0,0,0,0|2,0,0]=3 24 B23R2.377218 CC(C)(C)C#C/C=C/CSCc1cc(nc2c1cccc2)Cl 62a_200010137201_100016277853 [0,1,0,0,0,0|2,0,0]=3 25 B23R2.377218 CC(C)(C)C#CC=CCSCc1cc(nc2c1cccc2)Cl 62a_100000008102_200010137201 [0,1,0,0,0,0|2,0,0]=3 26 B23R2.377218 CC(C)(C)C#CC=CCSCc1cc(nc2c1cccc2)Cl 62a_200010137201_100000008102 [0,1,0,0,0,0|2,0,0]=3 27 B23R2.377218 Cc1cc(c2ccccc2n1)CSC/C=C/C#CC(C)(C)C 62a_100000755639_100016277853 [0,1,0,0,0,0|2,0,0]=3 28 B23R2.377218 Cc1cc(c2ccccc2n1)CSC/C=C/C#CC(C)(C)C 62a_100016277853_100000755639 [0,1,0,0,0,0|2,0,0]=3 29 B23R2.377218 Cc1cc(c2ccccc2n1)CSCC=CC#CC(C)(C)C 62a_100000008102_100000755639 [0,1,0,0,0,0|2,0,0]=3 30 B23R2.377218 Cc1cc(c2ccccc2n1)CSCC=CC#CC(C)(C)C 62a_100000755639_100000008102 [0,1,0,0,0,0|2,0,0]=3 31 B23R2.398499 CC(C)(C)C#C/C=C/COCc1c(ccc2c1nccc2)Cl 34a_100000698065_100016277853 [0,1,0,0,0,0|2,0,0]=3 32 B23R2.398499 CC(C)(C)C#CC=CCOCc1c(ccc2c1nccc2)Cl 34a_100000698065_100000008102 [0,1,0,0,0,0|2,0,0]=3 33 B23R2.398499 Cc1ccc2ccccc2c1CSC/C=C/C#CC(C)(C)C 62a_100000689653_100016277853 [0,1,0,0,0,0|1,0,0]=2 34 B23R2.398499 Cc1ccc2ccccc2c1CSC/C=C/C#CC(C)(C)C 62a_100016277853_100000689653 [0,1,0,0,0,0|1,0,0]=2 35 B23R2.398499 Cc1ccc2ccccc2c1CSCC=CC#CC(C)(C)C 62a_100000008102_100000689653 [0,1,0,0,0,0|1,0,0]=2 36 B23R2.398499 Cc1ccc2ccccc2c1CSCC=CC#CC(C)(C)C 62a_100000689653_100000008102 [0,1,0,0,0,0|1,0,0]=2 37 B23R2.8044420 CC(C)(C)C#C/C=C/CNCc1ccc(c2c1cccc2)Br 34a_100016995114_100016277853 [0,1,0,0,0,0|0,0,0]=1 38 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1cccc2)F 34a_100011988714_100016277853 [0,1,0,0,0,0|1,0,0]=2 39 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1cccc2)F 7a_100011988714_100016277853 [0,1,0,0,0,0|1,0,0]=2 40 B23R2.8044420 CC(C)(C)C#C/C=C/CSCc1ccc(c2c1cccc2)F 62a_100011988723_100016277853 [0,1,0,0,0,0|1,0,0]=2 41 B23R2.8044420 CC(C)(C)C#C/C=C/CSCc1ccc(c2c1cccc2)F 62a_100016277853_100011988723 [0,1,0,0,0,0|1,0,0]=2 42 B23R2.8044420 CC(C)(C)C#CC=CCNCc1ccc(c2c1cccc2)Br 34a_100016995114_100000008102 [0,1,0,0,0,0|0,0,0]=1 43 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1cccc2)F 34a_100011988714_100000008102 [0,1,0,0,0,0|1,0,0]=2 44 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1cccc2)F 7a_100011988714_100000008102 [0,1,0,0,0,0|1,0,0]=2 45 B23R2.8044420 CC(C)(C)C#CC=CCSCc1ccc(c2c1cccc2)F 62a_100000008102_100011988723 [0,1,0,0,0,0|1,0,0]=2 46 B23R2.8044420 CC(C)(C)C#CC=CCSCc1ccc(c2c1cccc2)F 62a_100011988723_100000008102 [0,1,0,0,0,0|1,0,0]=2 47 B23R2.8044420 C[Si](C)(C)C#CCCCNCc1ccc(c2c1cccc2)Br 34a_100016995114_200000066390 [0,1,0,0,0,0|0,1,2]=4 48 B23R2.8044420 Cc1ccc(c2c1cccc2)COC/C=C/C#CC(C)(C)C 34a_200011995996_100016277853 [0,1,0,0,0,0|1,0,0]=2 49 B23R2.8044420 Cc1ccc(c2c1cccc2)COC/C=C/C#CC(C)(C)C 7a_200011995996_100016277853 [0,1,0,0,0,0|1,0,0]=2 50 B23R2.8044420 Cc1ccc(c2c1cccc2)COCC=CC#CC(C)(C)C 34a_200011995996_100000008102 [0,1,0,0,0,0|1,0,0]=2 51 B23R2.8044420 Cc1ccc(c2c1cccc2)COCC=CC#CC(C)(C)C 7a_200011995996_100000008102 [0,1,0,0,0,0|1,0,0]=2 52 B23R2.8044420 Cc1ccc(c2c1cccc2)CSC/C=C/C#CC(C)(C)C 62a_100012073487_100016277853 [0,1,0,0,0,0|1,0,0]=2 53 B23R2.8044420 Cc1ccc(c2c1cccc2)CSC/C=C/C#CC(C)(C)C 62a_100016277853_100012073487 [0,1,0,0,0,0|1,0,0]=2 54 B23R2.8044420 Cc1ccc(c2c1cccc2)CSCC=CC#CC(C)(C)C 62a_100000008102_100012073487 [0,1,0,0,0,0|1,0,0]=2 55 B23R2.8044420 Cc1ccc(c2c1cccc2)CSCC=CC#CC(C)(C)C 62a_100012073487_100000008102 [0,1,0,0,0,0|1,0,0]=2 56 B23R2.53161218 CC(C)(C)C#C/C=C/COCc1cccc2c1c(ccc2)Br 34a_200009814114_100016277853 [0,1,0,0,0,0|1,0,0]=2 57 B23R2.53161218 CC(C)(C)C#C/C=C/COCc1cccc2c1c(ccc2)Br 7a_200009814114_100016277853 [0,1,0,0,0,0|1,0,0]=2 58 B23R2.53161218 CC(C)(C)C#CC=CCOCc1cccc2c1c(ccc2)Br 34a_200009814114_100000008102 [0,1,0,0,0,0|1,0,0]=2 59 B23R2.53161218 CC(C)(C)C#CC=CCOCc1cccc2c1c(ccc2)Br 7a_200009814114_100000008102 [0,1,0,0,0,0|1,0,0]=2 60 B23R2.245541889 C[C@H](NCC=CC#CC(C)(C)C)c1cccc2c1cccc2 2230a_100011830313_100000008102 [0,1,0,0,0,0|0,0,0]=1 61 B23R2.245541889 C[C@H](OC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 34a_100011852130_100016277853 [0,1,0,0,0,0|1,0,0]=2 62 B23R2.245541889 C[C@H](OC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 7a_100011852130_100016277853 [0,1,0,0,0,0|1,0,0]=2 63 B23R2.245541889 C[C@H](OCC=CC#CC(C)(C)C)c1cccc2c1cccc2 34a_100011852130_100000008102 [0,1,0,0,0,0|1,0,0]=2 64 B23R2.245541889 C[C@H](OCC=CC#CC(C)(C)C)c1cccc2c1cccc2 7a_100011852130_100000008102 [0,1,0,0,0,0|1,0,0]=2 65 B21R2.2827 CC(C)(C)C#C/C=C/COCc1csc2c1cccc2 34a_100011219454_100016277853 [0,0,0,0,1,0|2,0,0]=3 66 B21R2.2827 CC(C)(C)C#C/C=C/CSCc1csc2c1cccc2 62a_100016277853_200000742921 [0,0,0,0,1,0|2,0,0]=3 67 B21R2.2827 CC(C)(C)C#C/C=C/CSCc1csc2c1cccc2 62a_200000742921_100016277853 [0,0,0,0,1,0|2,0,0]=3 68 B21R2.2827 CC(C)(C)C#CC=CCOCc1csc2c1cccc2 34a_100011219454_100000008102 [0,0,0,0,1,0|2,0,0]=3 69 B21R2.2827 CC(C)(C)C#CC=CCSCc1csc2c1cccc2 62a_100000008102_200000742921 [0,0,0,0,1,0|2,0,0]=3 70 B21R2.2827 CC(C)(C)C#CC=CCSCc1csc2c1cccc2 62a_200000742921_100000008102 [0,0,0,0,1,0|2,0,0]=3 71 B21R2.12349703 CC(C)(C)C#C/C=C/CSCc1cccc2c1ncs2 62a_100010883896_100016277853 [0,0,0,0,1,0|3,0,0]=4 72 B21R2.12349703 CC(C)(C)C#C/C=C/CSCc1cccc2c1ncs2 62a_100016277853_100010883896 [0,0,0,0,1,0|3,0,0]=4 73 B21R2.12349703 CC(C)(C)C#C/C=C/CSCc1cccc2c1scc2 62a_100016277853_100009816938 [0,0,0,0,1,0|2,0,0]=3 74 B21R2.12349703 CC(C)(C)C#CC=CCSCc1cccc2c1ncs2 62a_100000008102_100010883896 [0,0,0,0,1,0|3,0,0]=4 75 B21R2.12349703 CC(C)(C)C#CC=CCSCc1cccc2c1ncs2 62a_100010883896_100000008102 [0,0,0,0,1,0|3,0,0]=4 76 B21R2.12349703 CC(C)(C)C#CC=CCSCc1cccc2c1scc2 62a_100000008102_100009816938 [0,0,0,0,1,0|2,0,0]=3 77 B21R2.49254128 CC(C)(C)C#C/C=C/CSc1cccc2c1cccc2 62a_100016277853_100000210605 [0,0,0,0,1,0|1,0,0]=2 78 B21R2.49254128 CC(C)(C)C#CC=CCSc1cccc2c1cccc2 62a_100000008102_100000210605 [0,0,0,0,1,0|1,0,0]=2 79 B21R2.49254128 C[Si](C)(C)C#CCCSCc1cccc2c1cccc2 62a_100010401983_100000188474 [0,0,0,0,1,0|1,1,1]=4 80 B21R2.49254128 C[Si](C)(C)C#CCCSCc1cccc2c1cccc2 62a_100011261445_100010401983 [0,0,0,0,1,0|1,1,1]=4 81 B21R2.49254128 C[Si](C)(C)C#CCSCCc1cccc2c1cccc2 62a_100000764098_100011290781 [0,0,0,0,1,0|1,1,1]=4 82 B21R2.49254128 C[Si](C)(C)C#CCSCCc1cccc2c1cccc2 62a_100011290781_100000764098 [0,0,0,0,1,0|1,1,1]=4 83 B23R2.177048297 CC(C)(C)C#C/C=C/COCCc1cccc2c1cccc2 34a_100011219628_100016277853 [0,0,0,0,0,1|1,0,0]=2 84 B23R2.177048297 CC(C)(C)C#C/C=C/COCCc1cccc2c1cccc2 7a_100011219628_100016277853 [0,0,0,0,0,1|1,0,0]=2 85 B23R2.177048297 CC(C)(C)C#C/C=C/CSCCc1cccc2c1cccc2 62a_100011290781_100016277853 [0,0,0,0,0,1|1,0,0]=2 86 B23R2.177048297 CC(C)(C)C#C/C=C/CSCCc1cccc2c1cccc2 62a_100016277853_100011290781 [0,0,0,0,0,1|1,0,0]=2 87 B23R2.177048297 CC(C)(C)C#CC=CCOCCc1cccc2c1cccc2 34a_100011219628_100000008102 [0,0,0,0,0,1|1,0,0]=2 88 B23R2.177048297 CC(C)(C)C#CC=CCOCCc1cccc2c1cccc2 7a_100011219628_100000008102 [0,0,0,0,0,1|1,0,0]=2 89 B23R2.177048297 CC(C)(C)C#CC=CCSCCc1cccc2c1cccc2 62a_100000008102_100011290781 [0,0,0,0,0,1|1,0,0]=2 90 B23R2.177048297 CC(C)(C)C#CC=CCSCCc1cccc2c1cccc2 62a_100011290781_100000008102 [0,0,0,0,0,1|1,0,0]=2 91 B22R2.15463 CC(C)(C)C#C/C=C/CC(=O)Cc1csc2c1cccc2 1458a_100000741031_100016277853 [0,1,0,0,1,0|2,0,0]=4 92 B22R2.15463 CC(C)(C)C#CC=CCC(=O)Cc1csc2c1cccc2 1458a_100000741031_100000008102 [0,1,0,0,1,0|2,0,0]=4 93 B22R2.4625136 CC(C)(C)C#C/C=C/COCc1csc2c1cc(cc2)Cl 34a_200000043707_100016277853 [0,1,0,0,1,0|2,0,0]=4 94 B22R2.4625136 CC(C)(C)C#C/C=C/COCc1csc2c1cc(cc2)Cl 7a_200000043707_100016277853 [0,1,0,0,1,0|2,0,0]=4 95 B22R2.4625136 CC(C)(C)C#C/C=C/CSCc1csc2c1cc(cc2)F 62a_100010109839_100016277853 [0,1,0,0,1,0|2,0,0]=4 96 B22R2.4625136 CC(C)(C)C#C/C=C/CSCc1csc2c1cc(cc2)F 62a_100016277853_100010109839 [0,1,0,0,1,0|2,0,0]=4 97 B22R2.4625136 CC(C)(C)C#CC=CCOCc1csc2c1cc(cc2)Cl 34a_200000043707_100000008102 [0,1,0,0,1,0|2,0,0]=4 98 B22R2.4625136 CC(C)(C)C#CC=CCOCc1csc2c1cc(cc2)Cl 7a_200000043707_100000008102 [0,1,0,0,1,0|2,0,0]=4 99 B22R2.4625136 CC(C)(C)C#CC=CCSCc1csc2c1cc(cc2)F 62a_100000008102_100010109839 [0,1,0,0,1,0|2,0,0]=4 100 B22R2.4625136 CC(C)(C)C#CC=CCSCc1csc2c1cc(cc2)F 62a_100010109839_100000008102 [0,1,0,0,1,0|2,0,0]=4 101 B22R2.145554 CC(C)(C)C#C/C=C/CNc1cccc2c1ccc(c2)Br 34a_100010090037_100016277853 [0,1,0,0,1,0|0,0,0]=2 102 B22R2.145554 CC(C)(C)C#C/C=C/CNc1cccc2c1ncc(c2)Br 34a_100000702407_100016277853 [0,1,0,0,1,0|1,0,0]=3 103 B22R2.145554 CC(C)(C)C#C/C=C/COc1cccc2c1ccc(c2)Br 34a_100010202202_100016277853 [0,1,0,0,1,0|1,0,0]=3 104 B22R2.145554 CC(C)(C)C#C/C=C/COc1cccc2c1ccc(c2)Br 7a_100010202202_100016277853 [0,1,0,0,1,0|1,0,0]=3 105 B22R2.145554 CC(C)(C)C#C/C=C/CSc1ccnc2c1ccc(c2)Cl 62a_100012352046_100016277853 [0,1,0,0,1,0|2,0,0]=4 106 B22R2.145554 CC(C)(C)C#C/C=C/CSc1ccnc2c1ccc(c2)Cl 62a_100016277853_100012352046 [0,1,0,0,1,0|2,0,0]=4 107 B22R2.145554 CC(C)(C)C#C/C=C/CSc1ccnc2c1ccc(c2)F 62a_100000755548_100016277853 [0,1,0,0,1,0|2,0,0]=4 108 B22R2.145554 CC(C)(C)C#C/C=C/CSc1ccnc2c1ccc(c2)F 62a_100016277853_100000755548 [0,1,0,0,1,0|2,0,0]=4 109 B22R2.145554 CC(C)(C)C#C/C=C/CSc1nccc2c1ccc(c2)F 62a_100016277853_100000097391 [0,1,0,0,1,0|2,0,0]=4 110 B22R2.145554 CC(C)(C)C#CC=CCNc1cccc2c1ccc(c2)Br 34a_100010090037_100000008102 [0,1,0,0,1,0|0,0,0]=2 111 B22R2.145554 CC(C)(C)C#CC=CCNc1cccc2c1ncc(c2)Br 34a_100000702407_100000008102 [0,1,0,0,1,0|1,0,0]=3 112 B22R2.145554 CC(C)(C)C#CC=CCOc1cccc2c1ccc(c2)Br 34a_100010202202_100000008102 [0,1,0,0,1,0|1,0,0]=3 113 B22R2.145554 CC(C)(C)C#CC=CCOc1cccc2c1ccc(c2)Br 7a_100010202202_100000008102 [0,1,0,0,1,0|1,0,0]=3 114 B22R2.145554 CC(C)(C)C#CC=CCSc1ccnc2c1ccc(c2)Cl 62a_100000008102_100012352046 [0,1,0,0,1,0|2,0,0]=4 115 B22R2.145554 CC(C)(C)C#CC=CCSc1ccnc2c1ccc(c2)Cl 62a_100012352046_100000008102 [0,1,0,0,1,0|2,0,0]=4 116 B22R2.145554 CC(C)(C)C#CC=CCSc1ccnc2c1ccc(c2)F 62a_100000008102_100000755548 [0,1,0,0,1,0|2,0,0]=4 117 B22R2.145554 CC(C)(C)C#CC=CCSc1ccnc2c1ccc(c2)F 62a_100000755548_100000008102 [0,1,0,0,1,0|2,0,0]=4 118 B22R2.145554 CC(C)(C)C#CC=CCSc1nccc2c1ccc(c2)F 62a_100000008102_100000097391 [0,1,0,0,1,0|2,0,0]=4 119 B22R2.145554 Cc1ccc2c(cccc2n1)SC/C=C/C#CC(C)(C)C 62a_100010173736_100016277853 [0,1,0,0,1,0|2,0,0]=4 120 B22R2.145554 Cc1ccc2c(cccc2n1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100010173736 [0,1,0,0,1,0|2,0,0]=4 121 B22R2.145554 Cc1ccc2c(cccc2n1)SCC=CC#CC(C)(C)C 62a_100000008102_100010173736 [0,1,0,0,1,0|2,0,0]=4 122 B22R2.145554 Cc1ccc2c(cccc2n1)SCC=CC#CC(C)(C)C 62a_100010173736_100000008102 [0,1,0,0,1,0|2,0,0]=4 123 B22R2.145554 Cc1ccc2c(nccc2c1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100000102439 [0,1,0,0,1,0|2,0,0]=4 124 B22R2.145554 Cc1ccc2c(nccc2c1)SCC=CC#CC(C)(C)C 62a_100000008102_100000102439 [0,1,0,0,1,0|2,0,0]=4 125 B22R2.290521 CC(C)(C)C#C/C=C/CNc1cc(cc2c1cccc2)Br 34a_100010171453_100016277853 [0,1,0,0,1,0|0,0,0]=2 126 B22R2.290521 CC(C)(C)C#C/C=C/CNc1cc(cc2c1nccc2)Br 34a_100009814519_100016277853 [0,1,0,0,1,0|1,0,0]=3 127 B22R2.290521 CC(C)(C)C#C/C=C/COc1cc(cc2c1cccc2)Br 34a_100010089979_100016277853 [0,1,0,0,1,0|1,0,0]=3 128 B22R2.290521 CC(C)(C)C#C/C=C/COc1cc(cc2c1cccc2)Br 7a_100010089979_100016277853 [0,1,0,0,1,0|1,0,0]=3 129 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1cccc2)N 62a_100010089974_100016277853 [0,1,0,0,1,0|1,0,0]=3 130 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1cccc2)N 62a_100016277853_100010089974 [0,1,0,0,1,0|1,0,0]=3 131 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1cccc2)O 62a_100016277853_100010001680 [0,1,0,0,1,0|1,0,0]=3 132 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1nccc2)Br 62a_100010090713_100016277853 [0,1,0,0,1,0|2,0,0]=4 133 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1nccc2)Br 62a_100016277853_100010090713 [0,1,0,0,1,0|2,0,0]=4 134 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1nccc2)F 62a_100010214460_100016277853 [0,1,0,0,1,0|2,0,0]=4 135 B22R2.290521 CC(C)(C)C#C/C=C/CSc1cc(cc2c1nccc2)F 62a_100016277853_100010214460 [0,1,0,0,1,0|2,0,0]=4 136 B22R2.290521 CC(C)(C)C#CC=CCNc1cc(cc2c1cccc2)Br 34a_100010171453_100000008102 [0,1,0,0,1,0|0,0,0]=2 137 B22R2.290521 CC(C)(C)C#CC=CCNc1cc(cc2c1nccc2)Br 34a_100009814519_100000008102 [0,1,0,0,1,0|1,0,0]=3 138 B22R2.290521 CC(C)(C)C#CC=CCOc1cc(cc2c1cccc2)Br 34a_100010089979_100000008102 [0,1,0,0,1,0|1,0,0]=3 139 B22R2.290521 CC(C)(C)C#CC=CCOc1cc(cc2c1cccc2)Br 7a_100010089979_100000008102 [0,1,0,0,1,0|1,0,0]=3 140 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1cccc2)N 62a_100000008102_100010089974 [0,1,0,0,1,0|1,0,0]=3 141 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1cccc2)N 62a_100010089974_100000008102 [0,1,0,0,1,0|1,0,0]=3 142 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1cccc2)O 62a_100000008102_100010001680 [0,1,0,0,1,0|1,0,0]=3 143 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1nccc2)Br 62a_100000008102_100010090713 [0,1,0,0,1,0|2,0,0]=4 144 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1nccc2)Br 62a_100010090713_100000008102 [0,1,0,0,1,0|2,0,0]=4 145 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1nccc2)F 62a_100000008102_100010214460 [0,1,0,0,1,0|2,0,0]=4 146 B22R2.290521 CC(C)(C)C#CC=CCSc1cc(cc2c1nccc2)F 62a_100010214460_100000008102 [0,1,0,0,1,0|2,0,0]=4 147 B22R2.290521 Cc1cc(c2ccccc2n1)SC/C=C/C#CC(C)(C)C 62a_100000764982_100016277853 [0,1,0,0,1,0|2,0,0]=4 148 B22R2.290521 Cc1cc(c2ccccc2n1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100000735862 [0,1,0,0,1,0|2,0,0]=4 149 B22R2.290521 Cc1cc(c2ccccc2n1)SCC=CC#CC(C)(C)C 62a_100000008102_100000735862 [0,1,0,0,1,0|2,0,0]=4 150 B22R2.290521 Cc1cc(c2ccccc2n1)SCC=CC#CC(C)(C)C 62a_100000764982_100000008102 [0,1,0,0,1,0|2,0,0]=4 151 B22R2.290521 Cc1cc(c2ncccc2c1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100010113427 [0,1,0,0,1,0|2,0,0]=4 152 B22R2.290521 Cc1cc(c2ncccc2c1)SCC=CC#CC(C)(C)C 62a_100000008102_100010113427 [0,1,0,0,1,0|2,0,0]=4 153 B22R2.290521 Cc1cc2ccccc2c(n1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100000698243 [0,1,0,0,1,0|2,0,0]=4 154 B22R2.290521 Cc1cc2ccccc2c(n1)SCC=CC#CC(C)(C)C 62a_100000008102_100000698243 [0,1,0,0,1,0|2,0,0]=4 155 B22R2.310176 CC(C)(C)C#C/C=C/CNc1c(ccc2c1cccc2)Br 34a_100009817101_100016277853 [0,1,0,0,1,0|0,0,0]=2 156 B22R2.310176 CC(C)(C)C#C/C=C/CNc1c(ccc2c1cccc2)Cl 34a_200009860907_100016277853 [0,1,0,0,1,0|0,0,0]=2 157 B22R2.310176 CC(C)(C)C#C/C=C/COc1c(ccc2c1cccc2)Br 34a_100009996032_100016277853 [0,1,0,0,1,0|1,0,0]=3 158 B22R2.310176 CC(C)(C)C#C/C=C/COc1c(ccc2c1cccc2)Br 7a_100009996032_100016277853 [0,1,0,0,1,0|1,0,0]=3 159 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1cccc2)N 62a_100000705303_100016277853 [0,1,0,0,1,0|1,0,0]=3 160 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1cccc2)N 62a_100016277853_100000705303 [0,1,0,0,1,0|1,0,0]=3 161 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1cccc2)O 62a_100016277853_100000183829 [0,1,0,0,1,0|1,0,0]=3 162 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1ccnc2)F 62a_100010272212_100016277853 [0,1,0,0,1,0|2,0,0]=4 163 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1ccnc2)F 62a_100016277853_100010272212 [0,1,0,0,1,0|2,0,0]=4 164 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1cncc2)F 62a_100016277853_200015767032 [0,1,0,0,1,0|2,0,0]=4 165 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(ccc2c1cncc2)F 62a_200015767032_100016277853 [0,1,0,0,1,0|2,0,0]=4 166 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(cnc2c1cccc2)Br 62a_100016277853_200010179490 [0,1,0,0,1,0|2,0,0]=4 167 B22R2.310176 CC(C)(C)C#C/C=C/CSc1c(cnc2c1cccc2)Br 62a_200010179490_100016277853 [0,1,0,0,1,0|2,0,0]=4 168 B22R2.310176 CC(C)(C)C#CC=CCNc1c(ccc2c1cccc2)Br 34a_100009817101_100000008102 [0,1,0,0,1,0|0,0,0]=2 169 B22R2.310176 CC(C)(C)C#CC=CCNc1c(ccc2c1cccc2)Cl 34a_200009860907_100000008102 [0,1,0,0,1,0|0,0,0]=2 170 B22R2.310176 CC(C)(C)C#CC=CCOc1c(ccc2c1cccc2)Br 34a_100009996032_100000008102 [0,1,0,0,1,0|1,0,0]=3 171 B22R2.310176 CC(C)(C)C#CC=CCOc1c(ccc2c1cccc2)Br 7a_100009996032_100000008102 [0,1,0,0,1,0|1,0,0]=3 172 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1cccc2)N 62a_100000008102_100000705303 [0,1,0,0,1,0|1,0,0]=3 173 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1cccc2)N 62a_100000705303_100000008102 [0,1,0,0,1,0|1,0,0]=3 174 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1cccc2)O 62a_100000008102_100000183829 [0,1,0,0,1,0|1,0,0]=3 175 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1ccnc2)F 62a_100000008102_100010272212 [0,1,0,0,1,0|2,0,0]=4 176 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1ccnc2)F 62a_100010272212_100000008102 [0,1,0,0,1,0|2,0,0]=4 177 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1cncc2)F 62a_100000008102_200015767032 [0,1,0,0,1,0|2,0,0]=4 178 B22R2.310176 CC(C)(C)C#CC=CCSc1c(ccc2c1cncc2)F 62a_200015767032_100000008102 [0,1,0,0,1,0|2,0,0]=4 179 B22R2.310176 CC(C)(C)C#CC=CCSc1c(cnc2c1cccc2)Br 62a_100000008102_200010179490 [0,1,0,0,1,0|2,0,0]=4 180 B22R2.310176 CC(C)(C)C#CC=CCSc1c(cnc2c1cccc2)Br 62a_200010179490_100000008102 [0,1,0,0,1,0|2,0,0]=4 181 B22R2.310176 Cc1ccc2ccccc2c1NC/C=C/C#CC(C)(C)C 34a_100000688109_100016277853 [0,1,0,0,1,0|0,0,0]=2 182 B22R2.310176 Cc1ccc2ccccc2c1NCC=CC#CC(C)(C)C 34a_100000688109_100000008102 [0,1,0,0,1,0|0,0,0]=2 183 B22R2.310176 Cc1ccc2ccccc2c1OC/C=C/C#CC(C)(C)C 34a_100000039261_100016277853 [0,1,0,0,1,0|1,0,0]=3 184 B22R2.310176 Cc1ccc2ccccc2c1OC/C=C/C#CC(C)(C)C 7a_100000039261_100016277853 [0,1,0,0,1,0|1,0,0]=3 185 B22R2.310176 Cc1ccc2ccccc2c1OCC=CC#CC(C)(C)C 34a_100000039261_100000008102 [0,1,0,0,1,0|1,0,0]=3 186 B22R2.310176 Cc1ccc2ccccc2c1OCC=CC#CC(C)(C)C 7a_100000039261_100000008102 [0,1,0,0,1,0|1,0,0]=3 187 B22R2.310176 Cc1ccc2ccccc2c1SC/C=C/C#CC(C)(C)C 62a_100000759710_100016277853 [0,1,0,0,1,0|1,0,0]=3 188 B22R2.310176 Cc1ccc2ccccc2c1SC/C=C/C#CC(C)(C)C 62a_100016277853_100000759710 [0,1,0,0,1,0|1,0,0]=3 189 B22R2.310176 Cc1ccc2ccccc2c1SCC=CC#CC(C)(C)C 62a_100000008102_100000759710 [0,1,0,0,1,0|1,0,0]=3 190 B22R2.310176 Cc1ccc2ccccc2c1SCC=CC#CC(C)(C)C 62a_100000759710_100000008102 [0,1,0,0,1,0|1,0,0]=3 191 B22R2.310176 Cc1ccc2cnccc2c1SC/C=C/C#CC(C)(C)C 62a_100010204589_100016277853 [0,1,0,0,1,0|2,0,0]=4 192 B22R2.310176 Cc1ccc2cnccc2c1SC/C=C/C#CC(C)(C)C 62a_100016277853_100010204589 [0,1,0,0,1,0|2,0,0]=4 193 B22R2.310176 Cc1ccc2cnccc2c1SCC=CC#CC(C)(C)C 62a_100000008102_100010204589 [0,1,0,0,1,0|2,0,0]=4 194 B22R2.310176 Cc1ccc2cnccc2c1SCC=CC#CC(C)(C)C 62a_100010204589_100000008102 [0,1,0,0,1,0|2,0,0]=4 195 B22R2.310176 Cc1cnc2ccccc2c1SC/C=C/C#CC(C)(C)C 62a_100016277853_100000092342 [0,1,0,0,1,0|2,0,0]=4 196 B22R2.310176 Cc1cnc2ccccc2c1SCC=CC#CC(C)(C)C 62a_100000008102_100000092342 [0,1,0,0,1,0|2,0,0]=4 197 B22R2.4007701 CC(C)(C)C#C/C=C/CNc1cccc2c1cc(cc2)Br 34a_100010090012_100016277853 [0,1,0,0,1,0|0,0,0]=2 198 B22R2.4007701 CC(C)(C)C#C/C=C/CNc1cccc2c1cc(cn2)Br 34a_100010264086_100016277853 [0,1,0,0,1,0|1,0,0]=3 199 B22R2.4007701 CC(C)(C)C#C/C=C/COc1cccc2c1cc(cc2)Br 34a_100010089991_100016277853 [0,1,0,0,1,0|1,0,0]=3 200 B22R2.4007701 CC(C)(C)C#C/C=C/COc1cccc2c1cc(cc2)Br 7a_100010089991_100016277853 [0,1,0,0,1,0|1,0,0]=3 201 B22R2.4007701 CC(C)(C)C#C/C=C/COc1cccc2c1cc(cc2)Cl 34a_100009840344_100016277853 [0,1,0,0,1,0|1,0,0]=3 202 B22R2.4007701 CC(C)(C)C#C/C=C/COc1cccc2c1cc(cc2)Cl 7a_100009840344_100016277853 [0,1,0,0,1,0|1,0,0]=3 203 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1cccc2c1cc(cc2)O 62a_100016277853_100010169565 [0,1,0,0,1,0|1,0,0]=3 204 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1cccc2c1nc(cc2)Cl 62a_100016277853_100012034269 [0,1,0,0,1,0|2,0,0]=4 205 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1ccnc2c1cc(cc2)Br 62a_100010189052_100016277853 [0,1,0,0,1,0|2,0,0]=4 206 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1ccnc2c1cc(cc2)Br 62a_100016277853_100010189052 [0,1,0,0,1,0|2,0,0]=4 207 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1ccnc2c1cc(cc2)F 62a_100011217270_100016277853 [0,1,0,0,1,0|2,0,0]=4 208 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1ccnc2c1cc(cc2)F 62a_100016277853_100011217270 [0,1,0,0,1,0|2,0,0]=4 209 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1nccc2c1cc(cc2)F 62a_100010202866_100016277853 [0,1,0,0,1,0|2,0,0]=4 210 B22R2.4007701 CC(C)(C)C#C/C=C/CSc1nccc2c1cc(cc2)F 62a_100016277853_100010202866 [0,1,0,0,1,0|2,0,0]=4 211 B22R2.4007701 CC(C)(C)C#CC=CCNc1cccc2c1cc(cc2)Br 34a_100010090012_100000008102 [0,1,0,0,1,0|0,0,0]=2 212 B22R2.4007701 CC(C)(C)C#CC=CCNc1cccc2c1cc(cn2)Br 34a_100010264086_100000008102 [0,1,0,0,1,0|1,0,0]=3 213 B22R2.4007701 CC(C)(C)C#CC=CCOc1cccc2c1cc(cc2)Br 34a_100010089991_100000008102 [0,1,0,0,1,0|1,0,0]=3 214 B22R2.4007701 CC(C)(C)C#CC=CCOc1cccc2c1cc(cc2)Br 7a_100010089991_100000008102 [0,1,0,0,1,0|1,0,0]=3 215 B22R2.4007701 CC(C)(C)C#CC=CCOc1cccc2c1cc(cc2)Cl 34a_100009840344_100000008102 [0,1,0,0,1,0|1,0,0]=3 216 B22R2.4007701 CC(C)(C)C#CC=CCOc1cccc2c1cc(cc2)Cl 7a_100009840344_100000008102 [0,1,0,0,1,0|1,0,0]=3 217 B22R2.4007701 CC(C)(C)C#CC=CCSc1cccc2c1cc(cc2)O 62a_100000008102_100010169565 [0,1,0,0,1,0|1,0,0]=3 218 B22R2.4007701 CC(C)(C)C#CC=CCSc1cccc2c1nc(cc2)Cl 62a_100000008102_100012034269 [0,1,0,0,1,0|2,0,0]=4 219 B22R2.4007701 CC(C)(C)C#CC=CCSc1ccnc2c1cc(cc2)Br 62a_100000008102_100010189052 [0,1,0,0,1,0|2,0,0]=4 220 B22R2.4007701 CC(C)(C)C#CC=CCSc1ccnc2c1cc(cc2)Br 62a_100010189052_100000008102 [0,1,0,0,1,0|2,0,0]=4 221 B22R2.4007701 CC(C)(C)C#CC=CCSc1ccnc2c1cc(cc2)F 62a_100000008102_100011217270 [0,1,0,0,1,0|2,0,0]=4 222 B22R2.4007701 CC(C)(C)C#CC=CCSc1ccnc2c1cc(cc2)F 62a_100011217270_100000008102 [0,1,0,0,1,0|2,0,0]=4 223 B22R2.4007701 CC(C)(C)C#CC=CCSc1nccc2c1cc(cc2)F 62a_100000008102_100010202866 [0,1,0,0,1,0|2,0,0]=4 224 B22R2.4007701 CC(C)(C)C#CC=CCSc1nccc2c1cc(cc2)F 62a_100010202866_100000008102 [0,1,0,0,1,0|2,0,0]=4 225 B22R2.4007701 Cc1ccc2cccc(c2c1)OC/C=C/C#CC(C)(C)C 34a_100000040781_100016277853 [0,1,0,0,1,0|1,0,0]=3 226 B22R2.4007701 Cc1ccc2cccc(c2c1)OC/C=C/C#CC(C)(C)C 7a_100000040781_100016277853 [0,1,0,0,1,0|1,0,0]=3 227 B22R2.4007701 Cc1ccc2cccc(c2c1)OCC=CC#CC(C)(C)C 34a_100000040781_100000008102 [0,1,0,0,1,0|1,0,0]=3 228 B22R2.4007701 Cc1ccc2cccc(c2c1)OCC=CC#CC(C)(C)C 7a_100000040781_100000008102 [0,1,0,0,1,0|1,0,0]=3 229 B22R2.4007701 Cc1ccc2cccc(c2n1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100011934484 [0,1,0,0,1,0|2,0,0]=4 230 B22R2.4007701 Cc1ccc2cccc(c2n1)SCC=CC#CC(C)(C)C 62a_100000008102_100011934484 [0,1,0,0,1,0|2,0,0]=4 231 B22R2.4007701 Cc1ccc2cncc(c2c1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100009817139 [0,1,0,0,1,0|2,0,0]=4 232 B22R2.4007701 Cc1ccc2cncc(c2c1)SCC=CC#CC(C)(C)C 62a_100000008102_100009817139 [0,1,0,0,1,0|2,0,0]=4 233 B22R2.4007701 Cc1ccc2nccc(c2c1)SC/C=C/C#CC(C)(C)C 62a_100016277853_100000751279 [0,1,0,0,1,0|2,0,0]=4 234 B22R2.4007701 Cc1ccc2nccc(c2c1)SCC=CC#CC(C)(C)C 62a_100000008102_100000751279 [0,1,0,0,1,0|2,0,0]=4 235 B22R2.5849808 CC(C)(C)C#C/C=C/CNc1cccc2c1cccc2Br 34a_100009816864_100016277853 [0,1,0,0,1,0|0,0,0]=2 236 B22R2.5849808 CC(C)(C)C#C/C=C/CNc1cccc2c1cccc2Cl 34a_100000077128_100016277853 [0,1,0,0,1,0|0,0,0]=2 237 B22R2.5849808 CC(C)(C)C#C/C=C/COc1cccc2c1cccc2Br 34a_100010003857_100016277853 [0,1,0,0,1,0|1,0,0]=3 238 B22R2.5849808 CC(C)(C)C#C/C=C/COc1cccc2c1cccc2Br 7a_100010003857_100016277853 [0,1,0,0,1,0|1,0,0]=3 239 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cccc2c1cccc2F 62a_100009817034_100016277853 [0,1,0,0,1,0|1,0,0]=3 240 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cccc2c1cccc2F 62a_100016277853_100009817034 [0,1,0,0,1,0|1,0,0]=3 241 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cccc2c1cccc2N 62a_100009816864_100016277853 [0,1,0,0,1,0|1,0,0]=3 242 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cccc2c1cccc2O 62a_100016277853_100010003857 [0,1,0,0,1,0|1,0,0]=3 243 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cccc2c1ccnc2Cl 62a_100016277853_100010080171 [0,1,0,0,1,0|2,0,0]=4 244 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1ccnc2c1cccc2F 62a_100011934723_100016277853 [0,1,0,0,1,0|2,0,0]=4 245 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1ccnc2c1cccc2F 62a_100016277853_100011934723 [0,1,0,0,1,0|2,0,0]=4 246 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cncc2c1cccc2F 62a_100010740057_100016277853 [0,1,0,0,1,0|2,0,0]=4 247 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1cncc2c1cccc2F 62a_100016277853_100010740057 [0,1,0,0,1,0|2,0,0]=4 248 B22R2.5849808 CC(C)(C)C#C/C=C/CSc1nccc2c1cccc2F 62a_100016277853_100012180906 [0,1,0,0,1,0|2,0,0]=4 249 B22R2.5849808 CC(C)(C)C#CC=CCNc1cccc2c1cccc2Br 34a_100009816864_100000008102 [0,1,0,0,1,0|0,0,0]=2 250 B22R2.5849808 CC(C)(C)C#CC=CCNc1cccc2c1cccc2Cl 34a_100000077128_100000008102 [0,1,0,0,1,0|0,0,0]=2 251 B22R2.5849808 CC(C)(C)C#CC=CCOc1cccc2c1cccc2Br 34a_100010003857_100000008102 [0,1,0,0,1,0|1,0,0]=3 252 B22R2.5849808 CC(C)(C)C#CC=CCOc1cccc2c1cccc2Br 7a_100010003857_100000008102 [0,1,0,0,1,0|1,0,0]=3 253 B22R2.5849808 CC(C)(C)C#CC=CCSc1cccc2c1cccc2F 62a_100000008102_100009817034 [0,1,0,0,1,0|1,0,0]=3 254 B22R2.5849808 CC(C)(C)C#CC=CCSc1cccc2c1cccc2F 62a_100009817034_100000008102 [0,1,0,0,1,0|1,0,0]=3 255 B22R2.5849808 CC(C)(C)C#CC=CCSc1cccc2c1cccc2N 62a_100009816864_100000008102 [0,1,0,0,1,0|1,0,0]=3 256 B22R2.5849808 CC(C)(C)C#CC=CCSc1cccc2c1cccc2O 62a_100000008102_100010003857 [0,1,0,0,1,0|1,0,0]=3 257 B22R2.5849808 CC(C)(C)C#CC=CCSc1cccc2c1ccnc2Cl 62a_100000008102_100010080171 [0,1,0,0,1,0|2,0,0]=4 258 B22R2.5849808 CC(C)(C)C#CC=CCSc1ccnc2c1cccc2F 62a_100000008102_100011934723 [0,1,0,0,1,0|2,0,0]=4 259 B22R2.5849808 CC(C)(C)C#CC=CCSc1ccnc2c1cccc2F 62a_100011934723_100000008102 [0,1,0,0,1,0|2,0,0]=4 260 B22R2.5849808 CC(C)(C)C#CC=CCSc1cncc2c1cccc2F 62a_100000008102_100010740057 [0,1,0,0,1,0|2,0,0]=4 261 B22R2.5849808 CC(C)(C)C#CC=CCSc1cncc2c1cccc2F 62a_100010740057_100000008102 [0,1,0,0,1,0|2,0,0]=4 262 B22R2.5849808 CC(C)(C)C#CC=CCSc1nccc2c1cccc2F 62a_100000008102_100012180906 [0,1,0,0,1,0|2,0,0]=4 263 B22R2.5849808 Cc1cccc2c1ccnc2SC/C=C/C#CC(C)(C)C 62a_100016277853_100012002547 [0,1,0,0,1,0|2,0,0]=4 264 B22R2.5849808 Cc1cccc2c1ccnc2SCC=CC#CC(C)(C)C 62a_100000008102_100012002547 [0,1,0,0,1,0|2,0,0]=4 265 B22R2.5849808 Cc1cccc2c1nccc2SC/C=C/C#CC(C)(C)C 62a_100016277853_100000751276 [0,1,0,0,1,0|2,0,0]=4 266 B22R2.5849808 Cc1cccc2c1nccc2SCC=CC#CC(C)(C)C 62a_100000008102_100000751276 [0,1,0,0,1,0|2,0,0]=4 267 B22R2.5849808 Cc1ccnc2c1cccc2SC/C=C/C#CC(C)(C)C 62a_100016277853_100010254272 [0,1,0,0,1,0|2,0,0]=4 268 B22R2.5849808 Cc1ccnc2c1cccc2SCC=CC#CC(C)(C)C 62a_100000008102_100010254272 [0,1,0,0,1,0|2,0,0]=4 269 B22R2.5849808 Cc1nccc2c1cccc2SC/C=C/C#CC(C)(C)C 62a_100010137443_100016277853 [0,1,0,0,1,0|2,0,0]=4 270 B22R2.5849808 Cc1nccc2c1cccc2SC/C=C/C#CC(C)(C)C 62a_100016277853_100010137443 [0,1,0,0,1,0|2,0,0]=4 271 B22R2.5849808 Cc1nccc2c1cccc2SCC=CC#CC(C)(C)C 62a_100000008102_100010137443 [0,1,0,0,1,0|2,0,0]=4 272 B22R2.5849808 Cc1nccc2c1cccc2SCC=CC#CC(C)(C)C 62a_100010137443_100000008102 [0,1,0,0,1,0|2,0,0]=4 273 B22R2.5979148 CC(C)(C)C#C/C=C/CNc1ccc(c2c1cccc2)Br 34a_100000766797_100016277853 [0,1,0,0,1,0|0,0,0]=2 274 B22R2.5979148 CC(C)(C)C#C/C=C/CNc1ccc(c2c1cccc2)Cl 34a_100011216319_100016277853 [0,1,0,0,1,0|0,0,0]=2 275 B22R2.5979148 CC(C)(C)C#C/C=C/CNc1ccc(c2c1cccc2)F 34a_100011988692_100016277853 [0,1,0,0,1,0|0,0,0]=2 276 B22R2.5979148 CC(C)(C)C#C/C=C/CNc1ccc(c2c1cccn2)Br 34a_100012360041_100016277853 [0,1,0,0,1,0|1,0,0]=3 277 B22R2.5979148 CC(C)(C)C#C/C=C/CNc1ccc(c2c1nccc2)Br 34a_100000726955_100016277853 [0,1,0,0,1,0|1,0,0]=3 278 B22R2.5979148 CC(C)(C)C#C/C=C/COc1ccc(c2c1cccc2)Br 34a_100000186334_100016277853 [0,1,0,0,1,0|1,0,0]=3 279 B22R2.5979148 CC(C)(C)C#C/C=C/COc1ccc(c2c1cccc2)Br 7a_100000186334_100016277853 [0,1,0,0,1,0|1,0,0]=3 280 B22R2.5979148 CC(C)(C)C#C/C=C/COc1ccc(c2c1cccc2)Cl 34a_100000211000_100016277853 [0,1,0,0,1,0|1,0,0]=3 281 B22R2.5979148 CC(C)(C)C#C/C=C/COc1ccc(c2c1cccc2)Cl 7a_100000211000_100016277853 [0,1,0,0,1,0|1,0,0]=3 282 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cccc2)F 62a_100011218216_100016277853 [0,1,0,0,1,0|1,0,0]=3 283 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cccc2)F 62a_100016277853_100011218216 [0,1,0,0,1,0|1,0,0]=3 284 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cccc2)N 62a_100000766797_100016277853 [0,1,0,0,1,0|1,0,0]=3 285 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cccc2)O 62a_100016277853_100000186334 [0,1,0,0,1,0|1,0,0]=3 286 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cccn2)F 62a_100010245834_100016277853 [0,1,0,0,1,0|2,0,0]=4 287 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cccn2)F 62a_100016277853_100010245834 [0,1,0,0,1,0|2,0,0]=4 288 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1ccnc2)F 62a_100000698020_100016277853 [0,1,0,0,1,0|2,0,0]=4 289 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1ccnc2)F 62a_100016277853_100000698020 [0,1,0,0,1,0|2,0,0]=4 290 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cncc2)F 62a_100010244717_100016277853 [0,1,0,0,1,0|2,0,0]=4 291 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1cncc2)F 62a_100016277853_100010244717 [0,1,0,0,1,0|2,0,0]=4 292 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1nccc2)F 62a_100010214461_100016277853 [0,1,0,0,1,0|2,0,0]=4 293 B22R2.5979148 CC(C)(C)C#C/C=C/CSc1ccc(c2c1nccc2)F 62a_100016277853_100010214461 [0,1,0,0,1,0|2,0,0]=4 294 B22R2.5979148 CC(C)(C)C#CC=CCNc1ccc(c2c1cccc2)Br 34a_100000766797_100000008102 [0,1,0,0,1,0|0,0,0]=2 295 B22R2.5979148 CC(C)(C)C#CC=CCNc1ccc(c2c1cccc2)Cl 34a_100011216319_100000008102 [0,1,0,0,1,0|0,0,0]=2 296 B22R2.5979148 CC(C)(C)C#CC=CCNc1ccc(c2c1cccc2)F 34a_100011988692_100000008102 [0,1,0,0,1,0|0,0,0]=2 297 B22R2.5979148 CC(C)(C)C#CC=CCNc1ccc(c2c1cccn2)Br 34a_100012360041_100000008102 [0,1,0,0,1,0|1,0,0]=3 298 B22R2.5979148 CC(C)(C)C#CC=CCNc1ccc(c2c1nccc2)Br 34a_100000726955_100000008102 [0,1,0,0,1,0|1,0,0]=3 299 B22R2.5979148 CC(C)(C)C#CC=CCOc1ccc(c2c1cccc2)Br 34a_100000186334_100000008102 [0,1,0,0,1,0|1,0,0]=3 300 B22R2.5979148 CC(C)(C)C#CC=CCOc1ccc(c2c1cccc2)Br 7a_100000186334_100000008102 [0,1,0,0,1,0|1,0,0]=3 301 B22R2.5979148 CC(C)(C)C#CC=CCOc1ccc(c2c1cccc2)Cl 34a_100000211000_100000008102 [0,1,0,0,1,0|1,0,0]=3 302 B22R2.5979148 CC(C)(C)C#CC=CCOc1ccc(c2c1cccc2)Cl 7a_100000211000_100000008102 [0,1,0,0,1,0|1,0,0]=3 303 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cccc2)F 62a_100000008102_100011218216 [0,1,0,0,1,0|1,0,0]=3 304 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cccc2)F 62a_100011218216_100000008102 [0,1,0,0,1,0|1,0,0]=3 305 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cccc2)N 62a_100000766797_100000008102 [0,1,0,0,1,0|1,0,0]=3 306 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cccc2)O 62a_100000008102_100000186334 [0,1,0,0,1,0|1,0,0]=3 307 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cccn2)F 62a_100000008102_100010245834 [0,1,0,0,1,0|2,0,0]=4 308 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cccn2)F 62a_100010245834_100000008102 [0,1,0,0,1,0|2,0,0]=4 309 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1ccnc2)F 62a_100000008102_100000698020 [0,1,0,0,1,0|2,0,0]=4 310 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1ccnc2)F 62a_100000698020_100000008102 [0,1,0,0,1,0|2,0,0]=4 311 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cncc2)F 62a_100000008102_100010244717 [0,1,0,0,1,0|2,0,0]=4 312 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1cncc2)F 62a_100010244717_100000008102 [0,1,0,0,1,0|2,0,0]=4 313 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1nccc2)F 62a_100000008102_100010214461 [0,1,0,0,1,0|2,0,0]=4 314 B22R2.5979148 CC(C)(C)C#CC=CCSc1ccc(c2c1nccc2)F 62a_100010214461_100000008102 [0,1,0,0,1,0|2,0,0]=4 315 B22R2.5979148 Cc1ccc(c2c1cccc2)OC/C=C/C#CC(C)(C)C 34a_100000074455_100016277853 [0,1,0,0,1,0|1,0,0]=3 316 B22R2.5979148 Cc1ccc(c2c1cccc2)OC/C=C/C#CC(C)(C)C 7a_100000074455_100016277853 [0,1,0,0,1,0|1,0,0]=3 317 B22R2.5979148 Cc1ccc(c2c1cccc2)OCC=CC#CC(C)(C)C 34a_100000074455_100000008102 [0,1,0,0,1,0|1,0,0]=3 318 B22R2.5979148 Cc1ccc(c2c1cccc2)OCC=CC#CC(C)(C)C 7a_100000074455_100000008102 [0,1,0,0,1,0|1,0,0]=3 319 B22R2.5979148 Cc1ccc(c2c1cccc2)SC/C=C/C#CC(C)(C)C 62a_100011215156_100016277853 [0,1,0,0,1,0|1,0,0]=3 320 B22R2.5979148 Cc1ccc(c2c1cccc2)SC/C=C/C#CC(C)(C)C 62a_100016277853_100011215156 [0,1,0,0,1,0|1,0,0]=3 321 B22R2.5979148 Cc1ccc(c2c1cccc2)SCC=CC#CC(C)(C)C 62a_100000008102_100011215156 [0,1,0,0,1,0|1,0,0]=3 322 B22R2.5979148 Cc1ccc(c2c1cccc2)SCC=CC#CC(C)(C)C 62a_100011215156_100000008102 [0,1,0,0,1,0|1,0,0]=3 323 B22R2.5979148 Cc1ccc(c2c1nccc2)SC/C=C/C#CC(C)(C)C 62a_100016277853_100000694312 [0,1,0,0,1,0|2,0,0]=4 324 B22R2.5979148 Cc1ccc(c2c1nccc2)SCC=CC#CC(C)(C)C 62a_100000008102_100000694312 [0,1,0,0,1,0|2,0,0]=4 325 B22R2.5979148 Cc1cnc(c2c1cccc2)SC/C=C/C#CC(C)(C)C 62a_100016277853_100000112005 [0,1,0,0,1,0|2,0,0]=4 326 B22R2.5979148 Cc1cnc(c2c1cccc2)SCC=CC#CC(C)(C)C 62a_100000008102_100000112005 [0,1,0,0,1,0|2,0,0]=4 327 B22R2.5979148 Cc1ncc(c2c1cccc2)SC/C=C/C#CC(C)(C)C 62a_100010239772_100016277853 [0,1,0,0,1,0|2,0,0]=4 328 B22R2.5979148 Cc1ncc(c2c1cccc2)SC/C=C/C#CC(C)(C)C 62a_100016277853_100010239772 [0,1,0,0,1,0|2,0,0]=4 329 B22R2.5979148 Cc1ncc(c2c1cccc2)SCC=CC#CC(C)(C)C 62a_100000008102_100010239772 [0,1,0,0,1,0|2,0,0]=4 330 B22R2.5979148 Cc1ncc(c2c1cccc2)SCC=CC#CC(C)(C)C 62a_100010239772_100000008102 [0,1,0,0,1,0|2,0,0]=4 331 B22R2.31436541 CC(C)(C)C#C/C=C/CNc1cccc2c1c(ccc2)Br 34a_100010002837_100016277853 [0,1,0,0,1,0|0,0,0]=2 332 B22R2.31436541 CC(C)(C)C#C/C=C/CNc1cccc2c1c(ccc2)Cl 34a_100009857565_100016277853 [0,1,0,0,1,0|0,0,0]=2 333 B22R2.31436541 CC(C)(C)C#C/C=C/CNc1cccc2c1c(ccc2)F 34a_100009878580_100016277853 [0,1,0,0,1,0|0,0,0]=2 334 B22R2.31436541 CC(C)(C)C#C/C=C/CNc1cccc2c1c(ccc2)F 7a_100009878580_100016277853 [0,1,0,0,1,0|0,0,0]=2 335 B22R2.31436541 CC(C)(C)C#C/C=C/CNc1cccc2c1c(cnc2)Br 34a_100000720362_100016277853 [0,1,0,0,1,0|1,0,0]=3 336 B22R2.31436541 CC(C)(C)C#C/C=C/COc1cccc2c1c(ccc2)Br 34a_100010089961_100016277853 [0,1,0,0,1,0|1,0,0]=3 337 B22R2.31436541 CC(C)(C)C#C/C=C/COc1cccc2c1c(ccc2)Br 7a_100010089961_100016277853 [0,1,0,0,1,0|1,0,0]=3 338 B22R2.31436541 CC(C)(C)C#C/C=C/CSc1cccc2c1c(ccc2)F 62a_100010177852_100016277853 [0,1,0,0,1,0|1,0,0]=3 339 B22R2.31436541 CC(C)(C)C#C/C=C/CSc1cccc2c1c(ccc2)F 62a_100016277853_100010177852 [0,1,0,0,1,0|1,0,0]=3 340 B22R2.31436541 CC(C)(C)C#C/C=C/CSc1cccc2c1c(ccc2)N 62a_100010002837_100016277853 [0,1,0,0,1,0|1,0,0]=3 341 B22R2.31436541 CC(C)(C)C#C/C=C/CSc1cccc2c1c(ccc2)O 62a_100016277853_100010089961 [0,1,0,0,1,0|1,0,0]=3 342 B22R2.31436541 CC(C)(C)C#CC=CCNc1cccc2c1c(ccc2)Br 34a_100010002837_100000008102 [0,1,0,0,1,0|0,0,0]=2 343 B22R2.31436541 CC(C)(C)C#CC=CCNc1cccc2c1c(ccc2)Cl 34a_100009857565_100000008102 [0,1,0,0,1,0|0,0,0]=2 344 B22R2.31436541 CC(C)(C)C#CC=CCNc1cccc2c1c(ccc2)F 34a_100009878580_100000008102 [0,1,0,0,1,0|0,0,0]=2 345 B22R2.31436541 CC(C)(C)C#CC=CCNc1cccc2c1c(ccc2)F 7a_100009878580_100000008102 [0,1,0,0,1,0|0,0,0]=2 346 B22R2.31436541 CC(C)(C)C#CC=CCNc1cccc2c1c(cnc2)Br 34a_100000720362_100000008102 [0,1,0,0,1,0|1,0,0]=3 347 B22R2.31436541 CC(C)(C)C#CC=CCOc1cccc2c1c(ccc2)Br 34a_100010089961_100000008102 [0,1,0,0,1,0|1,0,0]=3 348 B22R2.31436541 CC(C)(C)C#CC=CCOc1cccc2c1c(ccc2)Br 7a_100010089961_100000008102 [0,1,0,0,1,0|1,0,0]=3 349 B22R2.31436541 CC(C)(C)C#CC=CCSc1cccc2c1c(ccc2)F 62a_100000008102_100010177852 [0,1,0,0,1,0|1,0,0]=3 350 B22R2.31436541 CC(C)(C)C#CC=CCSc1cccc2c1c(ccc2)F 62a_100010177852_100000008102 [0,1,0,0,1,0|1,0,0]=3 351 B22R2.31436541 CC(C)(C)C#CC=CCSc1cccc2c1c(ccc2)N 62a_100010002837_100000008102 [0,1,0,0,1,0|1,0,0]=3 352 B22R2.31436541 CC(C)(C)C#CC=CCSc1cccc2c1c(ccc2)O 62a_100000008102_100010089961 [0,1,0,0,1,0|1,0,0]=3 353 B22R2.31436541 Cc1cccc2c1c(ccc2)NC/C=C/C#CC(C)(C)C 34a_100009841044_100016277853 [0,1,0,0,1,0|0,0,0]=2 354 B22R2.31436541 Cc1cccc2c1c(ccc2)NC/C=C/C#CC(C)(C)C 7a_100009841044_100016277853 [0,1,0,0,1,0|0,0,0]=2 355 B22R2.31436541 Cc1cccc2c1c(ccc2)NCC=CC#CC(C)(C)C 34a_100009841044_100000008102 [0,1,0,0,1,0|0,0,0]=2 356 B22R2.31436541 Cc1cccc2c1c(ccc2)NCC=CC#CC(C)(C)C 7a_100009841044_100000008102 [0,1,0,0,1,0|0,0,0]=2 357 B22R2.31436541 Cc1cccc2c1c(ccc2)SC/C=C/C#CC(C)(C)C 62a_100016277853_100009995290 [0,1,0,0,1,0|1,0,0]=3 358 B22R2.31436541 Cc1cccc2c1c(ccc2)SCC=CC#CC(C)(C)C 62a_100000008102_100009995290 [0,1,0,0,1,0|1,0,0]=3 359 B22R2.31436541 Cc1cncc2c1c(ccc2)SC/C=C/C#CC(C)(C)C 62a_100016277853_100009817140 [0,1,0,0,1,0|2,0,0]=4 360 B22R2.31436541 Cc1cncc2c1c(ccc2)SCC=CC#CC(C)(C)C 62a_100000008102_100009817140 [0,1,0,0,1,0|2,0,0]=4 361 B22R2.126863981 CC(C)(C)C#C/C=C/CC(=O)c1cccc2c1cccc2 1458a_100000210949_100016277853 [0,1,0,0,1,0|0,0,1]=3 362 B22R2.126863981 CC(C)(C)C#CC=CCC(=O)c1cccc2c1cccc2 1458a_100000210949_100000008102 [0,1,0,0,1,0|0,0,1]=3 363 B24R2.406157045 CC(C)(C)C#C/C=C/CC(=O)C=Cc1cccc2c1cccc2 1458a_100000735324_100016277853 [0,1,0,0,0,1|1,0,1]=4 364 B24R2.406157045 CC(C)(C)C#C/C=C/CC(=O)CCc1cccc2c1cccc2 1458a_100011218451_100016277853 [0,1,0,0,0,1|1,0,0]=3 365 B24R2.406157045 CC(C)(C)C#CC=CCC(=O)C=Cc1cccc2c1cccc2 1458a_100000735324_100000008102 [0,1,0,0,0,1|1,0,1]=4 366 B24R2.406157045 CC(C)(C)C#CC=CCC(=O)CCc1cccc2c1cccc2 1458a_100011218451_100000008102 [0,1,0,0,0,1|1,0,0]=3 367 B24R2.406260913 CC(C)(C)C#C/C=C/CSCC(=O)c1cccc2c1cccc2 62a_100000211450_100016277853 [0,1,0,0,0,1|1,0,0]=3 368 B24R2.406260913 CC(C)(C)C#C/C=C/CSCC(=O)c1cccc2c1cccc2 62a_100016277853_100000211450 [0,1,0,0,0,1|1,0,0]=3 369 B24R2.406260913 CC(C)(C)C#CC=CCSCC(=O)c1cccc2c1cccc2 62a_100000008102_100000211450 [0,1,0,0,0,1|1,0,0]=3 370 B24R2.406260913 CC(C)(C)C#CC=CCSCC(=O)c1cccc2c1cccc2 62a_100000211450_100000008102 [0,1,0,0,0,1|1,0,0]=3 371 B24R2.6543330 CC(OC/C=C/C#CC(C)(C)C)c1nccc2c1ccc(c2)Br 7a_200020640139_100016277853 [0,2,0,0,0,0|2,0,0]=4 372 B24R2.6543330 CC(OCC=CC#CC(C)(C)C)c1nccc2c1ccc(c2)Br 7a_200020640139_100000008102 [0,2,0,0,0,0|2,0,0]=4 373 B24R2.406006725 C[C@H](c1cccc2c1cccc2)N(C)C/C=C/C#CC(C)(C)C 269982a_100009815097_100016277853 [0,2,0,0,0,0|0,0,0]=2 374 B24R2.406006725 C[C@H](c1cccc2c1cccc2)N(C)CC=CC#CC(C)(C)C 2230a_100009815097_100000008102 [0,2,0,0,0,0|0,0,0]=2 375 B24R2.406006725 C[C@H](c1cccc2c1cccc2)N(C)CC=CC#CC(C)(C)C 269982a_100009815097_100000008102 [0,2,0,0,0,0|0,0,0]=2 376 B24R2.849942091 CC(C)(C)C#C/C=C/COC(C)(C)c1cccc2c1cccc2 34a_100011753710_100016277853 [0,2,0,0,0,0|1,0,0]=3 377 B24R2.849942091 CC(C)(C)C#C/C=C/COC(C)(C)c1cccc2c1cccc2 7a_100011753710_100016277853 [0,2,0,0,0,0|1,0,0]=3 378 B24R2.849942091 CC(C)(C)C#CC=CCNC(C)(C)c1cccc2c1cccc2 2230a_100020603280_100000008102 [0,2,0,0,0,0|0,0,0]=2 379 B24R2.849942091 CC(C)(C)C#CC=CCOC(C)(C)c1cccc2c1cccc2 34a_100011753710_100000008102 [0,2,0,0,0,0|1,0,0]=3 380 B24R2.849942091 CC(C)(C)C#CC=CCOC(C)(C)c1cccc2c1cccc2 7a_100011753710_100000008102 [0,2,0,0,0,0|1,0,0]=3 381 B22R2.290245 CC(C)(C)C#C/C=C/CNc1cc2ccccc2cc1Br 34a_100009991566_100016277853 [0,0,1,1,0,0|1,0,1]=4 382 B22R2.290245 CC(C)(C)C#C/C=C/CNc1cc2ccccc2cc1Br 7a_100009991566_100016277853 [0,0,1,1,0,0|1,0,1]=4 383 B22R2.290245 CC(C)(C)C#CC=CCNc1cc2ccccc2cc1Br 34a_100009991566_100000008102 [0,0,1,1,0,0|1,0,1]=4 384 B22R2.290245 CC(C)(C)C#CC=CCNc1cc2ccccc2cc1Br 7a_100009991566_100000008102 [0,0,1,1,0,0|1,0,1]=4 385 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1cc2ccccc2cn1 62a_100009869231_100016277853 [0,0,1,1,0,0|2,0,0]=4 386 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1cc2ccccc2cn1 62a_100016277853_100009869231 [0,0,1,1,0,0|2,0,0]=4 387 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2ccccc2c1 62a_100011216711_100016277853 [0,0,1,1,0,0|1,0,0]=3 388 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2ccccc2c1 62a_100016277853_100011216711 [0,0,1,1,0,0|1,0,0]=3 389 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2ccccc2n1 62a_100000737579_100016277853 [0,0,1,1,0,0|2,0,0]=4 390 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2ccccc2n1 62a_100016277853_100000737579 [0,0,1,1,0,0|2,0,0]=4 391 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2cnccc2c1 62a_100016277853_100020605334 [0,0,1,1,0,0|2,0,0]=4 392 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2cnccc2c1 62a_100020605334_100016277853 [0,0,1,1,0,0|2,0,0]=4 393 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2ncccc2c1 62a_100000703657_100016277853 [0,0,1,1,0,0|2,0,0]=4 394 B22R2.2845359 CC(C)(C)C#C/C=C/CSCc1ccc2ncccc2c1 62a_100016277853_100000703657 [0,0,1,1,0,0|2,0,0]=4 395 B22R2.2845359 CC(C)(C)C#CC=CCSCc1cc2ccccc2cn1 62a_100000008102_100009869231 [0,0,1,1,0,0|2,0,0]=4 396 B22R2.2845359 CC(C)(C)C#CC=CCSCc1cc2ccccc2cn1 62a_100009869231_100000008102 [0,0,1,1,0,0|2,0,0]=4 397 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2ccccc2c1 62a_100000008102_100011216711 [0,0,1,1,0,0|1,0,0]=3 398 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2ccccc2c1 62a_100011216711_100000008102 [0,0,1,1,0,0|1,0,0]=3 399 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2ccccc2n1 62a_100000008102_100000737579 [0,0,1,1,0,0|2,0,0]=4 400 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2ccccc2n1 62a_100000737579_100000008102 [0,0,1,1,0,0|2,0,0]=4 401 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2cnccc2c1 62a_100000008102_100020605334 [0,0,1,1,0,0|2,0,0]=4 402 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2cnccc2c1 62a_100020605334_100000008102 [0,0,1,1,0,0|2,0,0]=4 403 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2ncccc2c1 62a_100000008102_100000703657 [0,0,1,1,0,0|2,0,0]=4 404 B22R2.2845359 CC(C)(C)C#CC=CCSCc1ccc2ncccc2c1 62a_100000703657_100000008102 [0,0,1,1,0,0|2,0,0]=4 405 B22R2.20472441 CC(C)(C)C#C/C=C/CNc1ccc2ccccc2c1Br 34a_100000705303_100016277853 [0,0,1,1,0,0|1,0,1]=4 406 B22R2.20472441 CC(C)(C)C#C/C=C/CNc1ccc2ccccc2c1Cl 34a_100000075557_100016277853 [0,0,1,1,0,0|1,0,1]=4 407 B22R2.20472441 CC(C)(C)C#CC=CCNc1ccc2ccccc2c1Br 34a_100000705303_100000008102 [0,0,1,1,0,0|1,0,1]=4 408 B22R2.20472441 CC(C)(C)C#CC=CCNc1ccc2ccccc2c1Cl 34a_100000075557_100000008102 [0,0,1,1,0,0|1,0,1]=4 409 B24R3.121859159 CC(C)(C)C#C/C=C/COC1Cc2cccc3c2c1ccc3 34a_200000013446_100016277853 [0,0,0,1,0,1|1,0,0]=3 410 B24R3.121859159 CC(C)(C)C#C/C=C/COC1Cc2cccc3c2c1ccc3 7a_200000013446_100016277853 [0,0,0,1,0,1|1,0,0]=3 411 B24R3.121859159 CC(C)(C)C#CC=CCOC1Cc2cccc3c2c1ccc3 34a_200000013446_100000008102 [0,0,0,1,0,1|1,0,0]=3 412 B24R3.121859159 CC(C)(C)C#CC=CCOC1Cc2cccc3c2c1ccc3 7a_200000013446_100000008102 [0,0,0,1,0,1|1,0,0]=3 413 B20R2.2826 CC(C)(C)C#C/C=C/CSc1coc2c1cccc2 62a_100016277853_100009812202 [0,0,0,0,2,0|2,0,0]=4 414 B20R2.2826 CC(C)(C)C#C/C=C/CSc1csc2c1cccc2 62a_100016277853_100009813928 [0,0,0,0,2,0|2,0,0]=4 415 B20R2.2826 CC(C)(C)C#CC=CCSc1coc2c1cccc2 62a_100000008102_100009812202 [0,0,0,0,2,0|2,0,0]=4 416 B20R2.2826 CC(C)(C)C#CC=CCSc1csc2c1cccc2 62a_100000008102_100009813928 [0,0,0,0,2,0|2,0,0]=4 417 B20R2.7404367 CC(C)(C)C#C/C=C/CSc1cccc2c1cco2 62a_100016277853_100000756496 [0,0,0,0,2,0|2,0,0]=4 418 B20R2.7404367 CC(C)(C)C#C/C=C/CSc1cccc2c1ccs2 62a_100016277853_100009816950 [0,0,0,0,2,0|2,0,0]=4 419 B20R2.7404367 CC(C)(C)C#C/C=C/CSc1cccc2c1occ2 62a_100016277853_100011935138 [0,0,0,0,2,0|2,0,0]=4 420 B20R2.7404367 CC(C)(C)C#C/C=C/CSc1cccc2c1scc2 62a_100016277853_100000766737 [0,0,0,0,2,0|2,0,0]=4 421 B20R2.7404367 CC(C)(C)C#CC=CCSc1cccc2c1cco2 62a_100000008102_100000756496 [0,0,0,0,2,0|2,0,0]=4 422 B20R2.7404367 CC(C)(C)C#CC=CCSc1cccc2c1ccs2 62a_100000008102_100009816950 [0,0,0,0,2,0|2,0,0]=4 423 B20R2.7404367 CC(C)(C)C#CC=CCSc1cccc2c1occ2 62a_100000008102_100011935138 [0,0,0,0,2,0|2,0,0]=4 424 B20R2.7404367 CC(C)(C)C#CC=CCSc1cccc2c1scc2 62a_100000008102_100000766737 [0,0,0,0,2,0|2,0,0]=4 425 B24R2.198960889 CC(C)(C)C#C/C=C/CSCCOc1cccc2c1cccc2 62a_100000745918_100016277853 [0,0,0,0,0,2|1,0,0]=3 426 B24R2.198960889 CC(C)(C)C#C/C=C/CSCCOc1cccc2c1cccc2 62a_100016277853_100000745918 [0,0,0,0,0,2|1,0,0]=3 427 B24R2.198960889 CC(C)(C)C#CC=CCSCCOc1cccc2c1cccc2 62a_100000008102_100000745918 [0,0,0,0,0,2|1,0,0]=3 428 B24R2.198960889 CC(C)(C)C#CC=CCSCCOc1cccc2c1cccc2 62a_100000745918_100000008102 [0,0,0,0,0,2|1,0,0]=3