0 B23R3.26139327 C=C(C)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000730704 [0,0,0,0,0,0|3,0,1]=4 1 B23R3.26139327 C=C(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000730704 [0,0,0,0,0,0|3,0,1]=4 2 B23R3.26139327 C=C(C)CCSC1c2ccccc2CCc3c1cccc3 62a_100000730704_100000031795 [0,0,0,0,0,0|3,0,1]=4 3 B23R3.26139327 CC(=CCOC1c2ccccc2CCc3c1cccc3)C 34a_100000025823_100000761012 [0,0,0,0,0,0|3,0,1]=4 4 B23R3.26139327 CC(=CCOC1c2ccccc2CCc3c1cccc3)C 7a_100000025823_100000761012 [0,0,0,0,0,0|3,0,1]=4 5 B23R3.26139327 CC(=CCSC1c2ccccc2CCc3c1cccc3)C 62a_100000761012_100000031795 [0,0,0,0,0,0|3,0,1]=4 6 B23R3.26139327 CC(=O)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000053229 [0,0,0,0,0,0|4,0,0]=4 7 B23R3.26139327 CC(=O)CCOC1c2ccccc2CCc3c1cccc3 7a_100000759926_100000031795 [0,0,0,0,0,0|4,0,0]=4 8 B23R3.26139327 CC(=O)CCSC1c2ccccc2CCc3c1cccc3 62a_100000053229_100000031795 [0,0,0,0,0,0|4,0,0]=4 9 B23R3.26139327 CC(C)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000210312 [0,0,0,0,0,0|3,0,0]=3 10 B23R3.26139327 CC(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000210626 [0,0,0,0,0,0|3,0,0]=3 11 B23R3.26139327 CC(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000210254_100000031795 [0,0,0,0,0,0|3,0,0]=3 12 B23R3.26139327 CC(C)CCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000210626 [0,0,0,0,0,0|4,0,0]=4 13 B23R3.26139327 CC(C)CCSC1c2ccccc2CCc3c1cccc3 62a_100000210312_100000031795 [0,0,0,0,0,0|3,0,0]=3 14 B23R3.26139327 CC(C)OCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000709892 [0,0,0,0,0,0|4,0,0]=4 15 B23R3.26139327 CC(C)OCSC1c2ccccc2CCc3c1cccc3 62a_100000709892_100000031795 [0,0,0,0,0,0|4,0,0]=4 16 B23R3.26139327 CC(O)CCNC1c2ccccc2CCc3c1cccc3 2230a_200000755665_100000031795 [0,0,0,0,0,0|4,0,0]=4 17 B23R3.26139327 CC(O)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100012276601 [0,0,0,0,0,0|4,0,0]=4 18 B23R3.26139327 CC(O)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100012276601 [0,0,0,0,0,0|4,0,0]=4 19 B23R3.26139327 CC(O)CCSC1c2ccccc2CCc3c1cccc3 62a_100012276601_100000031795 [0,0,0,0,0,0|4,0,0]=4 20 B23R3.26139327 CN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_200000210301 [0,0,0,0,0,0|1,0,1]=2 21 B23R3.26139327 CN(C)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_200000210301 [0,0,0,0,0,0|1,0,1]=2 22 B23R3.26139327 CN(C)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_200000210301 [0,0,0,0,0,0|1,0,1]=2 23 B23R3.26139327 CN(C)CCOC1c2ccccc2C=Cc3c1cccc3 7a_100000036585_100000755713 [0,0,0,0,0,0|2,0,2]=4 24 B23R3.26139327 CN(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000755713 [0,0,0,0,0,0|2,0,0]=2 25 B23R3.26139327 CN(C)CCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000755713 [0,0,0,0,0,0|3,0,0]=3 26 B23R3.26139327 CN([13CH3])CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_200025704644 [0,0,0,0,0,0|1,0,1]=2 27 B23R3.26139327 CN([13CH3])CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_200025704644 [0,0,0,0,0,0|1,0,1]=2 28 B23R3.26139327 CN([13CH3])CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_200025704644 [0,0,0,0,0,0|1,0,1]=2 29 B22R3.12627361 CCCCNC1c2ccccc2CCc3c1cccc3 2230a_100000102301_100000031795 [1,0,0,0,0,0|3,0,0]=4 30 B22R3.12627361 CCCCNC1c2ccccc2CCc3c1cccc3 7a_106832991798_100000031795 [1,0,0,0,0,0|3,0,0]=4 31 B22R3.12627361 CCCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000210210 [1,0,0,0,0,0|3,0,0]=4 32 B22R3.12627361 CCCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000210211 [1,0,0,0,0,0|3,0,0]=4 33 B22R3.12627361 CCCCOC1c2ccccc2CCc3c1cccc3 7a_100000210227_100000031795 [1,0,0,0,0,0|3,0,0]=4 34 B22R3.12627361 CCCCSC1c2ccccc2CCc3c1cccc3 62a_100000210211_100000031795 [1,0,0,0,0,0|3,0,0]=4 35 B22R3.12627361 COCCNC1c2ccccc2CCc3c1cccc3 2230a_100000209980_100000031795 [1,0,0,0,0,0|3,0,0]=4 36 B22R3.12627361 COCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100011201679 [1,0,0,0,0,0|3,0,0]=4 37 B22R3.12627361 COCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000233755 [1,0,0,0,0,0|3,0,0]=4 38 B22R3.12627361 COCCSC1c2ccccc2CCc3c1cccc3 62a_100000233755_100000031795 [1,0,0,0,0,0|3,0,0]=4 39 B22R3.12627361 CSCCNC1c2ccccc2CCc3c1cccc3 2230a_100020590264_100000031795 [1,0,0,0,0,0|3,0,0]=4 40 B22R3.12627361 CSCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000212216 [1,0,0,0,0,0|3,0,0]=4 41 B22R3.12627361 CSCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000212216 [1,0,0,0,0,0|3,0,0]=4 42 B22R3.12627361 CSCCOC1c2ccccc2CCc3c1cccc3 7a_100000230434_100000031795 [1,0,0,0,0,0|3,0,0]=4 43 B22R3.12627361 CSCCSC1c2ccccc2CCc3c1cccc3 62a_100000212216_100000031795 [1,0,0,0,0,0|3,0,0]=4 44 B24R3.40764905 CC(CO)CCNC1c2ccccc2CCc3c1cccc3 2230a_106354213184_100000031795 [0,1,0,0,0,0|3,0,0]=4 45 B24R3.40764905 CCC(C)CCNC1c2ccccc2CCc3c1cccc3 2230a_100020591266_100000031795 [0,1,0,0,0,0|3,0,0]=4 46 B24R3.40764905 CCC(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100011215188_100000031795 [0,1,0,0,0,0|3,0,0]=4 47 B24R3.40764905 CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100000210202 [0,1,0,0,0,0|1,0,1]=3 48 B24R3.40764905 CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100000204670 [0,1,0,0,0,0|1,0,1]=3 49 B24R3.40764905 CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100000210202 [0,1,0,0,0,0|1,0,1]=3 50 B24R3.40764905 CN(CF)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100015361967 [0,1,0,0,0,0|1,0,1]=3 51 B24R3.40764905 CN(CF)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100015361967 [0,1,0,0,0,0|1,0,1]=3 52 B24R3.40764905 COC(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000764861_100000031795 [0,1,0,0,0,0|3,0,0]=4 53 B24R3.59644757 CC(C)C(O)CNC1c2ccccc2CCc3c1cccc3 2230a_100000759067_100000031795 [0,1,0,0,0,0|3,0,0]=4 54 B24R3.59644757 CN(C)C(=O)CNC1c2ccccc2CCc3c1cccc3 2230a_100015183351_100000031795 [0,1,0,0,0,0|2,0,1]=4 55 B24R3.59644757 CN(C)C(=O)COC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000692301 [0,1,0,0,0,0|2,0,1]=4 56 B24R3.59644757 CN(C)C(=O)COC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000692301 [0,1,0,0,0,0|2,0,1]=4 57 B24R3.59644757 CN(C)C(=O)CSC1c2ccccc2CCc3c1cccc3 62a_100000692301_100000031795 [0,1,0,0,0,0|2,0,1]=4 58 B24R3.65582311 CC(=O)CCC(=O)N1c2ccccc2CCc3c1cccc3 1458a_100000070787_200020598663 [0,1,0,0,0,0|2,0,1]=4 59 B24R3.65582311 CC(C)CCN(C)C1c2ccccc2CCc3c1cccc3 2230a_100000742789_100000031795 [0,1,0,0,0,0|3,0,0]=4 60 B24R3.65582311 CC(C)CCN(C)C1c2ccccc2CCc3c1cccc3 269982a_100000742789_100000031795 [0,1,0,0,0,0|3,0,0]=4 61 B24R3.65582311 CC(C)NCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_100138425928_200000596418 [0,1,0,0,0,0|2,0,1]=4 62 B24R3.65582311 CC(C)NCC(=O)N1c2ccccc2CCc3c1cccc3 34a_100138425928_200000596418 [0,1,0,0,0,0|2,0,1]=4 63 B24R3.65582311 CC(C)OCC(=O)N1c2ccccc2CCc3c1cccc3 34a_100000212225_200000596418 [0,1,0,0,0,0|2,0,1]=4 64 B24R3.65582311 CC(C)SCC(=O)N1c2ccccc2CCc3c1cccc3 62a_100000210206_200000596418 [0,1,0,0,0,0|2,0,1]=4 65 B24R3.65582311 CN(C)CCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_100102631434_200020598663 [0,1,0,0,0,0|0,0,1]=2 66 B24R3.65582311 CN(C)CCC(=O)N1c2ccccc2CCc3c1cccc3 269982a_100102631434_200020598663 [0,1,0,0,0,0|0,0,1]=2 67 B24R3.65582311 CN(C)CCN(C)C1c2ccccc2CCc3c1cccc3 269982a_100000225618_100000031795 [0,1,0,0,0,0|2,0,0]=3 68 B24R3.115675198 CC(C)CC(C)NC1c2ccccc2CCc3c1cccc3 2230a_100000692259_100000031795 [0,1,0,0,0,0|3,0,0]=4 69 B24R3.115675198 CC(C)CC(C)OC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000731052 [0,1,0,0,0,0|3,0,0]=4 70 B24R3.115675198 CC(C)CC(C)OC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000731052 [0,1,0,0,0,0|3,0,0]=4 71 B24R3.115675198 CC(C)CC(C)OC1c2ccccc2CCc3c1cccc3 7a_100000211805_100000031795 [0,1,0,0,0,0|3,0,0]=4 72 B24R3.115675198 CC(CN(C)C)SC1c2ccccc2CCc3c1cccc3 62a_100020606517_100000031795 [0,1,0,0,0,0|2,0,0]=3 73 B24R3.1505225918 CC(C)(C)CCNC1c2ccccc2CCc3c1cccc3 2230a_100000738805_100000031795 [0,1,0,0,0,0|3,0,0]=4 74 B24R3.1505225918 CC(C)(C)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000755188 [0,1,0,0,0,0|3,0,0]=4 75 B24R3.1505225918 CC(C)(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000755188 [0,1,0,0,0,0|3,0,0]=4 76 B24R3.1505225918 CC(C)(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000765024_100000031795 [0,1,0,0,0,0|3,0,0]=4 77 B24R3.1505225918 CC(C)(F)CCNC1c2ccccc2CCc3c1cccc3 2230a_100016253952_100000031795 [0,1,0,0,0,0|3,0,0]=4 78 B24R3.1505225918 CC(C)(O)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000702414 [0,1,0,0,0,0|3,0,0]=4 79 B24R3.1505225918 CC(C)(O)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000702414 [0,1,0,0,0,0|3,0,0]=4 80 B24R3.1505225918 CC(C)(O)CCSC1c2ccccc2CCc3c1cccc3 62a_100000702414_100000031795 [0,1,0,0,0,0|3,0,0]=4 81 B24R3.1505225918 C[N+](C)(C)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000085578 [0,1,0,0,0,0|2,0,1]=4 82 B24R3.1505225918 C[N+](C)(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000085578 [0,1,0,0,0,0|2,0,1]=4 83 B24R3.1505225918 C[N+](C)(C)CCOC1c2ccccc2CCc3c1cccc3 7a_200020618287_100000031795 [0,1,0,0,0,0|2,0,1]=4 84 B24R3.1505225918 C[N+](C)(C)CCSC1c2ccccc2CCc3c1cccc3 62a_100000085578_100000031795 [0,1,0,0,0,0|2,0,1]=4 85 B24R3.1505225918 C[Si](C)(C)CCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_200000733723 [0,1,0,0,0,0|3,0,0]=4 86 B24R3.1505225918 C[Si](C)(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_200000733723 [0,1,0,0,0,0|3,0,0]=4 87 B24R3.1505225918 C[Si](C)(C)CCOC1c2ccccc2CCc3c1cccc3 7a_100000039746_100000031795 [0,1,0,0,0,0|3,0,0]=4 88 B24R3.1505225918 C[Si](C)(C)CCSC1c2ccccc2CCc3c1cccc3 62a_200000733723_100000031795 [0,1,0,0,0,0|3,0,0]=4 89 B22R2.26914 CC(=CCCNc1ccccc1CCc2ccccn2)C 34a_200000071813_100011217483 [0,0,1,0,0,0|2,0,1]=4 90 B22R2.26914 CC(=CCCNc1ccccc1COc2ccccc2)C 2230a_100000742786_100011217483 [0,0,1,0,0,0|2,0,1]=4 91 B22R2.26914 CC(=CCCNc1ccccc1COc2ccccc2)C 34a_100000742786_100011217483 [0,0,1,0,0,0|2,0,1]=4 92 B22R2.26914 CC(=CCCNc1ccccc1COc2ccccc2)C 7a_100000742786_100011217483 [0,0,1,0,0,0|2,0,1]=4 93 B22R2.26914 CC(=CCCNc1ccccc1OCc2ccccc2)C 34a_100011193923_100011217483 [0,0,1,0,0,0|2,0,1]=4 94 B22R2.26914 CC(=CCCNc1ccccc1SCc2ccccc2)C 34a_100000198535_100011217483 [0,0,1,0,0,0|2,0,1]=4 95 B22R2.26914 CC(=CCCNc1ccccc1SCc2ccccc2)C 7a_100000198535_100011217483 [0,0,1,0,0,0|2,0,1]=4 96 B22R2.26914 CC(=O)CCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000685027 [0,0,1,0,0,0|3,0,0]=4 97 B22R2.26914 CC(=O)CCCNc1ccccc1COc2ccccc2 34a_100000742786_100000685027 [0,0,1,0,0,0|3,0,0]=4 98 B22R2.26914 CC(=O)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100011215641 [0,0,1,0,0,0|3,0,0]=4 99 B22R2.26914 CC(=O)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000685027 [0,0,1,0,0,0|3,0,0]=4 100 B22R2.26914 CC(=O)CCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000685027 [0,0,1,0,0,0|3,0,0]=4 101 B22R2.26914 CC(=O)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100011215641 [0,0,1,0,0,0|3,0,0]=4 102 B22R2.26914 CC(C)CCCNc1ccccc1C#Cc2ccccc2 2230a_100000044502_100011214892 [0,0,1,0,0,0|1,0,2]=4 103 B22R2.26914 CC(C)CCCNc1ccccc1C#Cc2ccccc2 34a_100000044502_100011214892 [0,0,1,0,0,0|1,0,2]=4 104 B22R2.26914 CC(C)CCCNc1ccccc1CCc2ccccn2 34a_200000071813_100011214892 [0,0,1,0,0,0|2,0,0]=3 105 B22R2.26914 CC(C)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_100011214892 [0,0,1,0,0,0|2,0,0]=3 106 B22R2.26914 CC(C)CCCNc1ccccc1COc2ccccc2 34a_100000742786_100011214892 [0,0,1,0,0,0|2,0,0]=3 107 B22R2.26914 CC(C)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100011214892 [0,0,1,0,0,0|2,0,0]=3 108 B22R2.26914 CC(C)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_100011214892 [0,0,1,0,0,0|2,0,0]=3 109 B22R2.26914 CC(C)CCCNc1ccccc1SCc2ccccc2 34a_100000198535_100011214892 [0,0,1,0,0,0|2,0,0]=3 110 B22R2.26914 CC(C)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100011214892 [0,0,1,0,0,0|2,0,0]=3 111 B22R2.26914 CC(C)CCCOc1ccccc1OCc2ccccc2 34a_100000187230_100011214892 [0,0,1,0,0,0|3,0,0]=4 112 B22R2.26914 CC(C)CCCOc1ccccc1OCc2ccccc2 7a_100000187230_100011214892 [0,0,1,0,0,0|3,0,0]=4 113 B22R2.26914 CC(C)CCCSc1ccccc1OCc2ccccc2 62a_100000151716_100011214892 [0,0,1,0,0,0|3,0,0]=4 114 B22R2.26914 CC(C)CCCSc1ccccc1OCc2ccccc2 62a_100011214892_100000151716 [0,0,1,0,0,0|3,0,0]=4 115 B22R2.26914 CC(C)CCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000210312 [0,0,1,0,0,0|3,0,0]=4 116 B22R2.26914 CC(C)CCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000210626 [0,0,1,0,0,0|3,0,0]=4 117 B22R2.26914 CC(C)OCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000211751 [0,0,1,0,0,0|3,0,0]=4 118 B22R2.26914 CC(C)OCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000211751 [0,0,1,0,0,0|3,0,0]=4 119 B22R2.26914 CC(C)OCCNc1ccccc1COc2ccccc2 34a_100000742786_100000211751 [0,0,1,0,0,0|3,0,0]=4 120 B22R2.26914 CC(C)OCCNc1ccccc1COc2ccccc2 7a_100000742786_100000211751 [0,0,1,0,0,0|3,0,0]=4 121 B22R2.26914 CC(C)OCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000211751 [0,0,1,0,0,0|3,0,0]=4 122 B22R2.26914 CC(C)OCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000211751 [0,0,1,0,0,0|3,0,0]=4 123 B22R2.26914 CC(C)OCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000211751 [0,0,1,0,0,0|3,0,0]=4 124 B22R2.26914 CC(C)SCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000730970 [0,0,1,0,0,0|3,0,0]=4 125 B22R2.26914 CC(C)SCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000730970 [0,0,1,0,0,0|3,0,0]=4 126 B22R2.26914 CC(C)SCCNc1ccccc1COc2ccccc2 34a_100000742786_100000730970 [0,0,1,0,0,0|3,0,0]=4 127 B22R2.26914 CC(C)SCCNc1ccccc1COc2ccccc2 7a_100000742786_100000730970 [0,0,1,0,0,0|3,0,0]=4 128 B22R2.26914 CC(C)SCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000730970 [0,0,1,0,0,0|3,0,0]=4 129 B22R2.26914 CC(C)SCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000730970 [0,0,1,0,0,0|3,0,0]=4 130 B22R2.26914 CC(C)SCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000730970 [0,0,1,0,0,0|3,0,0]=4 131 B22R2.26914 CC(O)CCCNc1ccccc1CCc2ccccn2 34a_200000071813_200000718107 [0,0,1,0,0,0|3,0,0]=4 132 B22R2.26914 CC(O)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_200000718107 [0,0,1,0,0,0|3,0,0]=4 133 B22R2.26914 CC(O)CCCNc1ccccc1COc2ccccc2 34a_100000742786_200000718107 [0,0,1,0,0,0|3,0,0]=4 134 B22R2.26914 CC(O)CCCNc1ccccc1COc2ccccc2 7a_100000742786_200000718107 [0,0,1,0,0,0|3,0,0]=4 135 B22R2.26914 CC(O)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_200000718107 [0,0,1,0,0,0|3,0,0]=4 136 B22R2.26914 CC(O)CCCNc1ccccc1SCc2ccccc2 34a_100000198535_200000718107 [0,0,1,0,0,0|3,0,0]=4 137 B22R2.26914 CC(O)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_200000718107 [0,0,1,0,0,0|3,0,0]=4 138 B22R2.26914 CN(C)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100000757444 [0,0,1,0,0,0|1,0,0]=2 139 B22R2.26914 CN(C)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000757444 [0,0,1,0,0,0|1,0,0]=2 140 B22R2.26914 CN(C)CCCNc1ncncc1OCc2ccccc2 27a_102531767803_100010760880 [0,0,1,0,0,0|3,0,0]=4 141 B22R2.26914 CN(C)CCCOc1ccccc1CNc2ccccc2 207a_100000106764_100015183612 [0,0,1,0,0,0|2,0,0]=3 142 B22R2.26914 CN(C)CCCOc1ccccc1CNc2ccccc2 270302a_100000106764_100015183612 [0,0,1,0,0,0|2,0,0]=3 143 B22R2.26914 CN(C)CCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000757444 [0,0,1,0,0,0|2,0,0]=3 144 B22R2.26914 CN(C)CCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000757444 [0,0,1,0,0,0|2,0,0]=3 145 B22R2.26914 CN(C)CCCSc1cccnc1OCc2ccccc2 62a_200011465151_100000757444 [0,0,1,0,0,0|3,0,0]=4 146 B22R2.26914 CN(C)CCCSc1ncccc1OCc2ccccc2 62a_100011501402_100000757444 [0,0,1,0,0,0|3,0,0]=4 147 B22R2.26914 CN(C)CCNCc1ccccc1OCc2ccccc2 207a_100000210585_100000151772 [0,0,1,0,0,0|3,0,0]=4 148 B22R2.26914 CN(C)CCNCc1ccccc1OCc2ccccc2 270004a_100000210585_100000151772 [0,0,1,0,0,0|3,0,0]=4 149 B22R2.26914 CN(C)CCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000755713 [0,0,1,0,0,0|2,0,0]=3 150 B22R2.26914 CN(C)CCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000755713 [0,0,1,0,0,0|3,0,0]=4 151 B22R2.604399 COc1ccccc1C(NCCN(C)C)c2ccccc2 270004a_100000210585_100011218802 [0,0,1,0,0,0|3,0,0]=4 152 B24R4.7210012 c1ccc2c(c1)CCc3ccccc3C2OCCC4CC4 34a_100000025823_100000694398 [0,0,0,1,0,0|3,0,0]=4 153 B24R4.7210012 c1ccc2c(c1)CCc3ccccc3C2OCCC4CC4 7a_100000025823_100000764125 [0,0,0,1,0,0|3,0,0]=4 154 B24R4.7210012 c1ccc2c(c1)CCc3ccccc3C2OCCC4CC4 7a_100000754188_100000031795 [0,0,0,1,0,0|3,0,0]=4 155 B24R4.7210012 c1ccc2c(c1)CCc3ccccc3C2SCCC4CC4 62a_100000764125_100000031795 [0,0,0,1,0,0|3,0,0]=4 156 B24R4.13494943 C[C@@H]1CCN(C1)C2c3ccccc3CCc4c2cccc4 2230a_100016987628_100000031795 [0,0,0,1,0,0|3,0,0]=4 157 B24R4.13494943 C[C@@H]1CCN(C1)C2c3ccccc3CCc4c2cccc4 269982a_100016987628_100000031795 [0,0,0,1,0,0|3,0,0]=4 158 B24R4.36422563 CC1CC1COC2c3ccccc3CCc4c2cccc4 7a_100000744939_100000031795 [0,0,0,1,0,0|3,0,0]=4 159 B22R3.12307660 CC(C)CNC1c2ccccc2CCc3c1cccc3 2230a_100000210953_100000031795 [0,0,0,0,1,0|3,0,0]=4 160 B22R3.12307660 CC(C)COC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000210624 [0,0,0,0,1,0|3,0,0]=4 161 B22R3.12307660 CC(C)COC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000210760 [0,0,0,0,1,0|3,0,0]=4 162 B22R3.12307660 CC(C)CSC1c2ccccc2CCc3c1cccc3 62a_100000210624_100000031795 [0,0,0,0,1,0|3,0,0]=4 163 B22R3.16182945 CN(C)CCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000755713 [0,0,0,0,1,0|3,0,0]=4 164 B22R3.16182945 CN(C)CCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000755713 [0,0,0,0,1,0|3,0,0]=4 165 B24R3.28516359 CC(=CCCOC1c2ccccc2CCc3c1cccc3)C 34a_100000025823_100011217483 [0,0,0,0,0,1|2,0,1]=4 166 B24R3.28516359 CC(=CCCOC1c2ccccc2CCc3c1cccc3)C 7a_100000025823_100011217483 [0,0,0,0,0,1|2,0,1]=4 167 B24R3.28516359 CC(=CCCSC1c2ccccc2CCc3c1cccc3)C 62a_100011217483_100000031795 [0,0,0,0,0,1|2,0,1]=4 168 B24R3.28516359 CC(=O)CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000685027 [0,0,0,0,0,1|3,0,0]=4 169 B24R3.28516359 CC(=O)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100011215641 [0,0,0,0,0,1|3,0,0]=4 170 B24R3.28516359 CC(=O)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000759063_100000031795 [0,0,0,0,0,1|3,0,0]=4 171 B24R3.28516359 CC(=O)CCCSC1c2ccccc2CCc3c1cccc3 62a_100011215641_100000031795 [0,0,0,0,0,1|3,0,0]=4 172 B24R3.28516359 CC(C)CCCNC1c2ccccc2CCc3c1cccc3 2230a_200000737386_100000031795 [0,0,0,0,0,1|2,0,0]=3 173 B24R3.28516359 CC(C)CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100011214892 [0,0,0,0,0,1|2,0,0]=3 174 B24R3.28516359 CC(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100011214892 [0,0,0,0,0,1|2,0,0]=3 175 B24R3.28516359 CC(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000210774_100000031795 [0,0,0,0,0,1|2,0,0]=3 176 B24R3.28516359 CC(C)CCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100011214892 [0,0,0,0,0,1|3,0,0]=4 177 B24R3.28516359 CC(C)OCCNC1c2ccccc2CCc3c1cccc3 2230a_100000701111_100000031795 [0,0,0,0,0,1|3,0,0]=4 178 B24R3.28516359 CC(C)OCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000211751 [0,0,0,0,0,1|3,0,0]=4 179 B24R3.28516359 CC(C)OCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000211751 [0,0,0,0,0,1|3,0,0]=4 180 B24R3.28516359 CC(C)OCCOC1c2ccccc2CCc3c1cccc3 7a_100000211219_100000031795 [0,0,0,0,0,1|3,0,0]=4 181 B24R3.28516359 CC(C)OCCSC1c2ccccc2CCc3c1cccc3 62a_100000211751_100000031795 [0,0,0,0,0,1|3,0,0]=4 182 B24R3.28516359 CC(C)SCCNC1c2ccccc2CCc3c1cccc3 2230a_100000731138_100000031795 [0,0,0,0,0,1|3,0,0]=4 183 B24R3.28516359 CC(C)SCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000730970 [0,0,0,0,0,1|3,0,0]=4 184 B24R3.28516359 CC(C)SCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000730970 [0,0,0,0,0,1|3,0,0]=4 185 B24R3.28516359 CC(C)SCCOC1c2ccccc2CCc3c1cccc3 7a_200011212901_100000031795 [0,0,0,0,0,1|3,0,0]=4 186 B24R3.28516359 CC(C)SCCSC1c2ccccc2CCc3c1cccc3 62a_100000730970_100000031795 [0,0,0,0,0,1|3,0,0]=4 187 B24R3.28516359 CC(O)CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_200000718107 [0,0,0,0,0,1|3,0,0]=4 188 B24R3.28516359 CC(O)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_200000718107 [0,0,0,0,0,1|3,0,0]=4 189 B24R3.28516359 CC(O)CCCSC1c2ccccc2CCc3c1cccc3 62a_200000718107_100000031795 [0,0,0,0,0,1|3,0,0]=4 190 B24R3.28516359 CN(C)CCCOC1c2ccccc2C=Cc3c1cccc3 7a_100000036585_100000757444 [0,0,0,0,0,1|1,0,2]=4 191 B24R3.28516359 CN(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000757444 [0,0,0,0,0,1|1,0,0]=2 192 B24R3.28516359 CN(C)CCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100000757444 [0,0,0,0,0,1|2,0,0]=3 193 B24R3.28516359 CS(=O)CCCNC1c2ccccc2CCc3c1cccc3 2230a_200000753449_100000031795 [0,0,0,0,0,1|3,0,0]=4 194 B21R2.14087 CCCCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000718602 [1,0,1,0,0,0|2,0,0]=4 195 B21R2.14087 CCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000210326 [1,0,1,0,0,0|2,0,0]=4 196 B21R2.14087 CCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000718602 [1,0,1,0,0,0|2,0,0]=4 197 B21R2.14087 CCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000210326 [1,0,1,0,0,0|2,0,0]=4 198 B21R2.14087 CCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000718602 [1,0,1,0,0,0|2,0,0]=4 199 B21R2.14087 CCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000718602 [1,0,1,0,0,0|2,0,0]=4 200 B21R2.14087 CCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000210326 [1,0,1,0,0,0|2,0,0]=4 201 B21R2.14087 CNCCCOc1ccccc1SCc2ccccc2 62a_100000211182_100015186278 [1,0,1,0,0,0|2,0,0]=4 202 B21R2.14087 CNCCCOc1ccccc1SCc2ccccc2 62a_100015186278_100015291786 [1,0,1,0,0,0|2,0,0]=4 203 B21R2.14087 COCCCNc1ccccc1CCc2ccccn2 34a_200000071813_100000740836 [1,0,1,0,0,0|2,0,0]=4 204 B21R2.14087 COCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000740836 [1,0,1,0,0,0|2,0,0]=4 205 B21R2.14087 COCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000740836 [1,0,1,0,0,0|2,0,0]=4 206 B21R2.14087 COCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000740836 [1,0,1,0,0,0|2,0,0]=4 207 B21R2.14087 COCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000740836 [1,0,1,0,0,0|2,0,0]=4 208 B21R2.14087 COCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000740836 [1,0,1,0,0,0|2,0,0]=4 209 B21R2.14087 COCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000740836 [1,0,1,0,0,0|2,0,0]=4 210 B21R2.205989 Cc1ccccc1C(NCCN(C)C)c2ccccc2 270004a_100000210585_100000735561 [1,0,1,0,0,0|2,0,0]=4 211 B21R2.205989 Cc1ccccc1C(OCCN(C)C)c2ccccc2 7a_100000212071_100000755713 [1,0,1,0,0,0|2,0,0]=4 212 B21R2.205989 Cc1ccccc1C(SCCN(C)C)c2ccccc2 62a_100000230135_100000755713 [1,0,1,0,0,0|2,0,0]=4 213 B21R3.590114 CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000210303 [2,0,0,0,0,0|2,0,0]=4 214 B21R3.590114 CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000210303 [2,0,0,0,0,0|2,0,0]=4 215 B21R3.590114 CCCSC1c2ccccc2CCc3c1cccc3 62a_100000210303_100000031795 [2,0,0,0,0,0|2,0,0]=4 216 B23R2.12192 CC(C)CCCNc1ccccc1SCc2ccccc2F 34a_100015187786_100011214892 [0,1,1,0,0,0|2,0,0]=4 217 B23R2.12192 CC(C)CCCNc1ccccc1SCc2ccccc2F 7a_100015187786_100011214892 [0,1,1,0,0,0|2,0,0]=4 218 B23R2.12192 CN(C)CCCNc1ccccc1SCc2ccccc2Cl 7a_100015185902_100000757444 [0,1,1,0,0,0|1,0,0]=3 219 B23R2.12192 CN(C)CCCNc1ccccc1SCc2ccccc2F 7a_100015187786_100000757444 [0,1,1,0,0,0|1,0,0]=3 220 B23R2.12192 CN(C)CCCOc1ccccc1CNc2ccccc2Br 207a_100000210017_100015183612 [0,1,1,0,0,0|2,0,0]=4 221 B23R2.12192 CN(C)CCCOc1ccccc1CNc2ccccc2Cl 207a_100000185783_100015183612 [0,1,1,0,0,0|2,0,0]=4 222 B23R2.12192 CN(C)CCCOc1ccccc1CNc2ccccc2F 207a_100000210422_100015183612 [0,1,1,0,0,0|2,0,0]=4 223 B23R2.12192 CN(C)CCCOc1ccccc1CNc2ccccc2I 207a_100000210053_100015183612 [0,1,1,0,0,0|2,0,0]=4 224 B23R2.12192 Cc1ccccc1COc2ccccc2SCCCN(C)C 62a_100000151724_100000757444 [0,1,1,0,0,0|2,0,0]=4 225 B23R2.12192 Cc1ccccc1NCc2ccccc2OCCCN(C)C 207a_100015192222_100015183612 [0,1,1,0,0,0|2,0,0]=4 226 B23R2.12192 Cc1ccccc1NCc2ccccc2OCCCN(C)C 270302a_100015192222_100015183612 [0,1,1,0,0,0|2,0,0]=4 227 B23R2.26041 CC(C)CCCNc1ccccc1SCc2ccc(cc2)F 2230a_100015187171_100011214892 [0,1,1,0,0,0|2,0,0]=4 228 B23R2.26041 CC(C)CCCNc1ccccc1SCc2ccc(cc2)F 34a_100015187171_100011214892 [0,1,1,0,0,0|2,0,0]=4 229 B23R2.26041 CC(C)CCCNc1ccccc1SCc2ccc(cc2)F 7a_100015187171_100011214892 [0,1,1,0,0,0|2,0,0]=4 230 B23R2.26041 CN(C)CCCNc1ccccc1SCc2ccc(cc2)Cl 7a_100000299865_100000757444 [0,1,1,0,0,0|1,0,0]=3 231 B23R2.26041 CN(C)CCCNc1ccccc1SCc2ccc(cc2)F 7a_100015187171_100000757444 [0,1,1,0,0,0|1,0,0]=3 232 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)Br 207a_100000210018_100015183612 [0,1,1,0,0,0|2,0,0]=4 233 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)Br 270302a_100000210018_100015183612 [0,1,1,0,0,0|2,0,0]=4 234 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)Cl 207a_100000210052_100015183612 [0,1,1,0,0,0|2,0,0]=4 235 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)Cl 270302a_100000210052_100015183612 [0,1,1,0,0,0|2,0,0]=4 236 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)F 207a_100000185862_100015183612 [0,1,1,0,0,0|2,0,0]=4 237 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)F 270302a_100000185862_100015183612 [0,1,1,0,0,0|2,0,0]=4 238 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)I 207a_100000185761_100015183612 [0,1,1,0,0,0|2,0,0]=4 239 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)I 270302a_100000185761_100015183612 [0,1,1,0,0,0|2,0,0]=4 240 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000757444 [0,1,1,0,0,0|2,0,0]=4 241 B23R2.26041 CN(C)CCCOc1ccccc1CNc2ccc(cc2)O 270302a_100000185829_100015183612 [0,1,1,0,0,0|2,0,0]=4 242 B23R2.26041 CN(C)CCCSc1ccccc1OCc2ccc(cc2)F 62a_200000151720_100000757444 [0,1,1,0,0,0|2,0,0]=4 243 B23R2.26041 Cc1ccc(cc1)CSc2ccccc2NCCCN(C)C 7a_200015186568_100000757444 [0,1,1,0,0,0|1,0,0]=3 244 B23R2.26041 Cc1ccc(cc1)NCc2ccccc2OCCCN(C)C 207a_100000124888_100015183612 [0,1,1,0,0,0|2,0,0]=4 245 B23R2.26041 Cc1ccc(cc1)NCc2ccccc2OCCCN(C)C 270302a_100000124888_100015183612 [0,1,1,0,0,0|2,0,0]=4 246 B23R2.29827 CCN(C)CCCNc1ccccc1C#Cc2ccccc2 2230a_100000044502_100015186262 [0,1,1,0,0,0|0,0,2]=4 247 B23R2.29827 CCN(C)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_100015186262 [0,1,1,0,0,0|1,0,0]=3 248 B23R2.29827 CCN(C)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100015186262 [0,1,1,0,0,0|1,0,0]=3 249 B23R2.29827 CCN(C)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100015186262 [0,1,1,0,0,0|1,0,0]=3 250 B23R2.29827 CCN(C)CCCOc1ccccc1OCc2ccccc2 7a_100000187230_100015186262 [0,1,1,0,0,0|2,0,0]=4 251 B23R2.29827 CCN(C)CCCSc1ccccc1OCc2ccccc2 62a_100000151716_100015186262 [0,1,1,0,0,0|2,0,0]=4 252 B23R2.49036 CN(C)C(=O)CCNc1ccccc1COc2ccccc2 2230a_100000742786_100000737620 [0,1,1,0,0,0|1,0,1]=4 253 B23R2.49036 CN(C)C(=O)CCNc1ccccc1COc2ccccc2 7a_100000742786_100000737620 [0,1,1,0,0,0|1,0,1]=4 254 B23R2.49036 CN(C)C(=O)CCNc1ccccc1SCc2ccccc2 7a_100000198535_100000737620 [0,1,1,0,0,0|1,0,1]=4 255 B23R2.162062 CC(CNc1ccccc1C#Cc2ccccc2)CN(C)C 2230a_100000044502_100015348159 [0,1,1,0,0,0|0,0,2]=4 256 B23R2.162062 CC(CNc1ccccc1COc2ccccc2)CN(C)C 2230a_100000742786_100015348159 [0,1,1,0,0,0|1,0,0]=3 257 B23R2.162062 CC(CNc1ccccc1COc2ccccc2)CN(C)C 7a_100000742786_100015348159 [0,1,1,0,0,0|1,0,0]=3 258 B23R2.162062 CC(CNc1ccccc1SCc2ccccc2)CN(C)C 7a_100000198535_100015348159 [0,1,1,0,0,0|1,0,0]=3 259 B23R2.162062 CC(COc1ccccc1OCc2ccccc2)CN(C)C 7a_100000187230_100015348159 [0,1,1,0,0,0|2,0,0]=4 260 B23R2.162062 CC(CSc1ccccc1OCc2ccccc2)CN(C)C 62a_100000151716_100015348159 [0,1,1,0,0,0|2,0,0]=4 261 B23R2.162062 CC(CSc1ccccc1OCc2ccccc2)CN(C)C 62a_100015348159_100000151716 [0,1,1,0,0,0|2,0,0]=4 262 B23R2.182447 CC(C)CCCNc1cc(ccc1OCc2ccccc2)Br 2230a_200011228974_100011214892 [0,1,1,0,0,0|2,0,0]=4 263 B23R2.182447 CC(C)CCCNc1cc(ccc1OCc2ccccc2)Br 34a_200011228974_100011214892 [0,1,1,0,0,0|2,0,0]=4 264 B23R2.182447 CC(C)CCCNc1cc(ccc1OCc2ccccc2)Br 7a_200011228974_100011214892 [0,1,1,0,0,0|2,0,0]=4 265 B23R2.182447 CN(C)CCCNc1cc(ccc1OCc2ccccc2)Br 7a_200011228974_100000757444 [0,1,1,0,0,0|1,0,0]=3 266 B23R2.182447 CN(C)CCCSc1cc(ccc1OCc2ccccc2)F 62a_200000151671_100000757444 [0,1,1,0,0,0|2,0,0]=4 267 B23R2.182447 Cc1ccc(c(c1)SCCCN(C)C)OCc2ccccc2 62a_100000151733_100000757444 [0,1,1,0,0,0|2,0,0]=4 268 B23R2.268595 CC(C)CCCNc1cccc(c1OCc2ccccc2)F 2230a_100013039107_100011214892 [0,1,1,0,0,0|2,0,0]=4 269 B23R2.268595 CC(C)CCCNc1cccc(c1OCc2ccccc2)F 34a_100013039107_100011214892 [0,1,1,0,0,0|2,0,0]=4 270 B23R2.392971 CC(C)CCCNc1ccccc1SCc2cccc(c2)F 2230a_100015187172_100011214892 [0,1,1,0,0,0|2,0,0]=4 271 B23R2.392971 CC(C)CCCNc1ccccc1SCc2cccc(c2)F 34a_100015187172_100011214892 [0,1,1,0,0,0|2,0,0]=4 272 B23R2.392971 CC(C)CCCNc1ccccc1SCc2cccc(c2)F 7a_100015187172_100011214892 [0,1,1,0,0,0|2,0,0]=4 273 B23R2.392971 CN(C)CCCNc1ccccc1SCc2cccc(c2)Cl 7a_100015184656_100000757444 [0,1,1,0,0,0|1,0,0]=3 274 B23R2.392971 CN(C)CCCNc1ccccc1SCc2cccc(c2)F 7a_100015187172_100000757444 [0,1,1,0,0,0|1,0,0]=3 275 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)Br 207a_100000210019_100015183612 [0,1,1,0,0,0|2,0,0]=4 276 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)Br 270302a_100000210019_100015183612 [0,1,1,0,0,0|2,0,0]=4 277 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)Cl 207a_100000185859_100015183612 [0,1,1,0,0,0|2,0,0]=4 278 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)Cl 270302a_100000185859_100015183612 [0,1,1,0,0,0|2,0,0]=4 279 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)F 207a_100000210047_100015183612 [0,1,1,0,0,0|2,0,0]=4 280 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)F 270302a_100000210047_100015183612 [0,1,1,0,0,0|2,0,0]=4 281 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)I 207a_100000211102_100015183612 [0,1,1,0,0,0|2,0,0]=4 282 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)I 270302a_100000211102_100015183612 [0,1,1,0,0,0|2,0,0]=4 283 B23R2.392971 CN(C)CCCOc1ccccc1CNc2cccc(c2)O 270302a_100000210217_100015183612 [0,1,1,0,0,0|2,0,0]=4 284 B23R2.392971 Cc1cccc(c1)CSc2ccccc2NCCCN(C)C 7a_200015184035_100000757444 [0,1,1,0,0,0|1,0,0]=3 285 B23R2.392971 Cc1cccc(c1)NCc2ccccc2OCCCN(C)C 207a_100000188690_100015183612 [0,1,1,0,0,0|2,0,0]=4 286 B23R2.392971 Cc1cccc(c1)NCc2ccccc2OCCCN(C)C 270302a_100000188690_100015183612 [0,1,1,0,0,0|2,0,0]=4 287 B23R2.397578 CC(C)CCCNc1ccc(cc1OCc2ccccc2)F 2230a_100011195462_100011214892 [0,1,1,0,0,0|2,0,0]=4 288 B23R2.397578 CC(C)CCCNc1ccc(cc1OCc2ccccc2)F 34a_100011195462_100011214892 [0,1,1,0,0,0|2,0,0]=4 289 B23R2.397578 CC(C)CCCNc1ccc(cc1OCc2ccccc2)F 7a_100011195462_100011214892 [0,1,1,0,0,0|2,0,0]=4 290 B23R2.397578 CN(C)CCCNc1ccc(cc1OCc2ccccc2)F 7a_100011195462_100000757444 [0,1,1,0,0,0|1,0,0]=3 291 B23R2.397578 CN(C)CCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000757444 [0,1,1,0,0,0|2,0,0]=4 292 B23R2.397578 CN(C)CCCSc1ccc(cc1OCc2ccccc2)F 62a_100012355265_100000757444 [0,1,1,0,0,0|2,0,0]=4 293 B23R2.397578 Cc1ccc(c(c1)OCc2ccccc2)NCCCC(C)C 2230a_100011220564_100011214892 [0,1,1,0,0,0|2,0,0]=4 294 B23R2.397578 Cc1ccc(c(c1)OCc2ccccc2)NCCCC(C)C 34a_100011220564_100011214892 [0,1,1,0,0,0|2,0,0]=4 295 B23R2.470008 CC(C)CCCNc1ccccc1N(C)Cc2ccccc2 2230a_100000745351_100011214892 [0,1,1,0,0,0|2,0,0]=4 296 B23R2.470008 CN(C)CCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100000757444 [0,1,1,0,0,0|1,0,1]=4 297 B23R2.472034 CC(C)CCCC(=O)c1ccccc1CCc2ccccc2 1458a_100000610640_100011214892 [0,1,1,0,0,0|2,0,0]=4 298 B23R2.472034 CN(C)CCCC(=O)c1ccccc1CCc2ccccc2 1458a_100000610640_100000695564 [0,1,1,0,0,0|1,0,0]=3 299 B23R2.472034 CN(C)CCCC(=O)c1ccccc1COc2ccccc2 1458a_100000272412_100000695564 [0,1,1,0,0,0|2,0,0]=4 300 B23R2.472034 CN(C)CCCC(=O)c1ccccc1CSc2ccccc2 1458a_100000292687_100000695564 [0,1,1,0,0,0|2,0,0]=4 301 B23R2.472034 CN(C)CCCC(=O)c1ccccc1OCc2ccccc2 1458a_100000183716_100000695564 [0,1,1,0,0,0|2,0,0]=4 302 B23R2.472034 CN(C)CCNC(=O)c1ccccc1CCc2ccccc2 240690a_100000210585_100000610640 [0,1,1,0,0,0|2,0,0]=4 303 B23R2.472034 CN(C)CCNC(=O)c1ccccc1CCc2ccccc2 527a_100000210585_100000610640 [0,1,1,0,0,0|2,0,0]=4 304 B23R2.472552 CC(C)CCC(C)Nc1ccccc1CCc2ccccn2 34a_200000071813_100011261404 [0,1,1,0,0,0|2,0,0]=4 305 B23R2.472552 CC(C)CCC(C)Nc1ccccc1COc2ccccc2 2230a_100000742786_100011261404 [0,1,1,0,0,0|2,0,0]=4 306 B23R2.472552 CC(C)CCC(C)Nc1ccccc1COc2ccccc2 34a_100000742786_100011261404 [0,1,1,0,0,0|2,0,0]=4 307 B23R2.472552 CC(C)CCC(C)Nc1ccccc1OCc2ccccc2 34a_100011193923_100011261404 [0,1,1,0,0,0|2,0,0]=4 308 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1CCc2ccccn2 11a_200000071813_100000689311 [0,1,1,0,0,0|1,0,1]=4 309 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1CCc2ccccn2 22a_200000071813_100000689311 [0,1,1,0,0,0|1,0,1]=4 310 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1CCc2ccccn2 527a_200000071813_100000689311 [0,1,1,0,0,0|1,0,1]=4 311 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1COc2ccccc2 11a_100000742786_100000689311 [0,1,1,0,0,0|1,0,1]=4 312 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1COc2ccccc2 22a_100000742786_100000689311 [0,1,1,0,0,0|1,0,1]=4 313 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1COc2ccccc2 527a_100000742786_100000689311 [0,1,1,0,0,0|1,0,1]=4 314 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1OCc2ccccc2 11a_100011193923_100000689311 [0,1,1,0,0,0|1,0,1]=4 315 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1OCc2ccccc2 22a_100011193923_100000689311 [0,1,1,0,0,0|1,0,1]=4 316 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1OCc2ccccc2 527a_100011193923_100000689311 [0,1,1,0,0,0|1,0,1]=4 317 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1SCc2ccccc2 11a_100000198535_100000689311 [0,1,1,0,0,0|1,0,1]=4 318 B23R2.472552 CN(C)CCC(=O)Nc1ccccc1SCc2ccccc2 22a_100000198535_100000689311 [0,1,1,0,0,0|1,0,1]=4 319 B23R2.5110902 CC(C)(O)CCCNc1ccccc1CCc2ccccn2 34a_200000071813_100009888830 [0,1,1,0,0,0|2,0,0]=4 320 B23R2.5110902 CC(C)(O)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_100009888830 [0,1,1,0,0,0|2,0,0]=4 321 B23R2.5110902 CC(C)(O)CCCNc1ccccc1COc2ccccc2 34a_100000742786_100009888830 [0,1,1,0,0,0|2,0,0]=4 322 B23R2.5110902 CC(C)(O)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100009888830 [0,1,1,0,0,0|2,0,0]=4 323 B23R2.5110902 CC(C)(O)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_100009888830 [0,1,1,0,0,0|2,0,0]=4 324 B23R2.5110902 CC(C)(O)CCCNc1ccccc1SCc2ccccc2 34a_100000198535_100009888830 [0,1,1,0,0,0|2,0,0]=4 325 B23R2.5110902 CC(C)(O)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100009888830 [0,1,1,0,0,0|2,0,0]=4 326 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1CCc2ccccn2 34a_200000071813_100016990835 [0,1,1,0,0,0|1,0,1]=4 327 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_100016990835 [0,1,1,0,0,0|1,0,1]=4 328 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1COc2ccccc2 34a_100000742786_100016990835 [0,1,1,0,0,0|1,0,1]=4 329 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100016990835 [0,1,1,0,0,0|1,0,1]=4 330 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_100016990835 [0,1,1,0,0,0|1,0,1]=4 331 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1SCc2ccccc2 34a_100000198535_100016990835 [0,1,1,0,0,0|1,0,1]=4 332 B23R2.5110902 C[N+](C)(C)CCCNc1ccccc1SCc2ccccc2 7a_100000198535_100016990835 [0,1,1,0,0,0|1,0,1]=4 333 B23R2.5110902 C[Si](C)(C)CCCNc1ccccc1CCc2ccccn2 34a_200000071813_100011219597 [0,1,1,0,0,0|2,0,0]=4 334 B23R2.5110902 C[Si](C)(C)CCCNc1ccccc1COc2ccccc2 2230a_100000742786_100011219597 [0,1,1,0,0,0|2,0,0]=4 335 B23R2.5110902 C[Si](C)(C)CCCNc1ccccc1COc2ccccc2 34a_100000742786_100011219597 [0,1,1,0,0,0|2,0,0]=4 336 B23R2.5110902 C[Si](C)(C)CCCNc1ccccc1COc2ccccc2 7a_100000742786_100011219597 [0,1,1,0,0,0|2,0,0]=4 337 B23R2.5110902 C[Si](C)(C)CCCNc1ccccc1OCc2ccccc2 34a_100011193923_100011219597 [0,1,1,0,0,0|2,0,0]=4 338 B23R3.25657126 CCCCCNC1c2ccccc2CCc3c1cccc3 2230a_100000209983_100000031795 [1,1,0,0,0,0|2,0,0]=4 339 B23R3.25657126 CCCCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000718602 [1,1,0,0,0,0|2,0,0]=4 340 B23R3.25657126 CCCCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000210326 [1,1,0,0,0,0|2,0,0]=4 341 B23R3.25657126 CCCCCOC1c2ccccc2CCc3c1cccc3 7a_100000210253_100000031795 [1,1,0,0,0,0|2,0,0]=4 342 B23R3.25657126 CCCCCSC1c2ccccc2CCc3c1cccc3 62a_100000210326_100000031795 [1,1,0,0,0,0|2,0,0]=4 343 B23R3.25657126 COCCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100000740836 [1,1,0,0,0,0|2,0,0]=4 344 B23R3.25657126 COCCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000740836 [1,1,0,0,0,0|2,0,0]=4 345 B23R3.25657126 COCCCSC1c2ccccc2CCc3c1cccc3 62a_100000709357_100000031795 [1,1,0,0,0,0|2,0,0]=4 346 B23R3.25657126 CSCCCNC1c2ccccc2CCc3c1cccc3 2230a_100000749238_100000031795 [1,1,0,0,0,0|2,0,0]=4 347 B23R3.25657126 CSCCCOC1c2ccccc2CCc3c1cccc3 7a_100000690336_100000031795 [1,1,0,0,0,0|2,0,0]=4 348 B23R3.32306063 CNCCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_106832991635_200020598663 [1,1,0,0,0,0|0,0,1]=3 349 B23R3.32306063 CNCCC(=O)N1c2ccccc2CCc3c1cccc3 7a_106832991635_200020598663 [1,1,0,0,0,0|0,0,1]=3 350 B23R3.32306063 CSCCC(=O)N1c2ccccc2CCc3c1cccc3 62a_200000210301_200020598663 [1,1,0,0,0,0|1,0,1]=4 351 B23R3.32306063 [13CH3]SCCC(=O)N1c2ccccc2CCc3c1cccc3 62a_200025704644_200020598663 [1,1,0,0,0,0|1,0,1]=4 352 B23R3.71811993 CN(C)CC(=O)N1c2ccccc2CCc3c1cccc3 2230a_100102631434_200000596418 [0,1,0,0,1,0|0,0,1]=3 353 B23R3.71811993 CN(C)CC(=O)N1c2ccccc2CCc3c1cccc3 269982a_100102631434_200000596418 [0,1,0,0,1,0|0,0,1]=3 354 B23R3.38550080 CN(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 11a_100102631434_200000489519 [0,1,0,0,1,0|1,0,1]=4 355 B23R3.38550080 CN(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 240690a_100102631434_200000489519 [0,1,0,0,1,0|1,0,1]=4 356 B23R3.38550080 CN(C)C(=O)CCN1c2ccccc2Sc3c1cccc3 527a_100102631434_200000489519 [0,1,0,0,1,0|1,0,1]=4 357 B23R3.41925352 CN(C)CCC(=O)N1c2ccccc2Sc3c1cccc3 2230a_100102631434_200015341630 [0,1,0,0,1,0|1,0,1]=4 358 B23R3.41925352 CN(C)CCC(=O)N1c2ccccc2Sc3c1cccc3 269982a_100102631434_200015341630 [0,1,0,0,1,0|1,0,1]=4 359 B25R3.46981908 CCC(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100011216074_100000031795 [0,1,0,0,0,1|2,0,0]=4 360 B25R3.46981908 CCN(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100015186262 [0,1,0,0,0,1|1,0,0]=3 361 B25R3.46981908 CCN(C)CCCOC1c2ccccc2CSc3c1cccc3 7a_100025745337_100015186262 [0,1,0,0,0,1|2,0,0]=4 362 B25R3.66670882 CN(C)C(=O)CCNC1c2ccccc2CCc3c1cccc3 2230a_100000738053_100000031795 [0,1,0,0,0,1|1,0,1]=4 363 B25R3.66670882 CN(C)C(=O)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000737620 [0,1,0,0,0,1|1,0,1]=4 364 B25R3.66670882 CN(C)C(=O)CCSC1c2ccccc2CCc3c1cccc3 62a_100000737620_100000031795 [0,1,0,0,0,1|1,0,1]=4 365 B25R3.72609343 CC(C)(O)CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100009888830 [0,1,0,0,0,1|2,0,0]=4 366 B25R3.72609343 CC(C)(O)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100009888830 [0,1,0,0,0,1|2,0,0]=4 367 B25R3.72609343 CC(C)(O)CCCSC1c2ccccc2CCc3c1cccc3 62a_100009888830_100000031795 [0,1,0,0,0,1|2,0,0]=4 368 B25R3.72609343 C[N+](C)(C)CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100016990835 [0,1,0,0,0,1|1,0,1]=4 369 B25R3.72609343 C[N+](C)(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100016990835 [0,1,0,0,0,1|1,0,1]=4 370 B25R3.72609343 C[N+](C)(C)CCCSC1c2ccccc2CCc3c1cccc3 62a_100016990835_100000031795 [0,1,0,0,0,1|1,0,1]=4 371 B25R3.72609343 C[Si](C)(C)CCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100011219597 [0,1,0,0,0,1|2,0,0]=4 372 B25R3.72609343 C[Si](C)(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100011219597 [0,1,0,0,0,1|2,0,0]=4 373 B25R3.72609343 C[Si](C)(C)CCCOC1c2ccccc2CCc3c1cccc3 7a_200011215415_100000031795 [0,1,0,0,0,1|2,0,0]=4 374 B25R3.73122306 CC(C)CCC(C)NC1c2ccccc2CCc3c1cccc3 2230a_100138410893_100000031795 [0,1,0,0,0,1|2,0,0]=4 375 B25R3.73122306 CC(C)CCC(C)OC1c2ccccc2CCc3c1cccc3 34a_100000025823_100011261404 [0,1,0,0,0,1|2,0,0]=4 376 B25R3.73122306 CC(C)CCC(C)OC1c2ccccc2CCc3c1cccc3 7a_100011215350_100000031795 [0,1,0,0,0,1|2,0,0]=4 377 B25R3.120010569 CC(COC1c2ccccc2CCc3c1cccc3)CN(C)C 7a_100000025823_100015348159 [0,1,0,0,0,1|1,0,0]=3 378 B25R3.120010569 CC(COC1c2ccccc2CSc3c1cccc3)CN(C)C 7a_100025745337_100015348159 [0,1,0,0,0,1|2,0,0]=4 379 B25R3.120010569 CC(CSC1c2ccccc2CCc3c1cccc3)CN(C)C 62a_100015348159_100000031795 [0,1,0,0,0,1|1,0,0]=3 380 B25R3.230826632 CC(C)CNCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_100000210953_200000596418 [0,1,0,0,0,1|1,0,1]=4 381 B25R3.230826632 CC(C)CNCC(=O)N1c2ccccc2CCc3c1cccc3 34a_100000210953_200000596418 [0,1,0,0,0,1|1,0,1]=4 382 B25R3.230826632 CC(C)COCC(=O)N1c2ccccc2CCc3c1cccc3 34a_100000210257_200000596418 [0,1,0,0,0,1|1,0,1]=4 383 B25R3.230826632 CC(C)CSCC(=O)N1c2ccccc2CCc3c1cccc3 62a_100000210624_200000596418 [0,1,0,0,0,1|1,0,1]=4 384 B25R3.230826632 CC(C)NCCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_100138425928_200020598663 [0,1,0,0,0,1|1,0,1]=4 385 B25R3.230826632 CC(C)SCCC(=O)N1c2ccccc2CCc3c1cccc3 62a_100000210206_200020598663 [0,1,0,0,0,1|1,0,1]=4 386 B25R3.230826632 CN(C)CCCN(C)C1c2ccccc2CCc3c1cccc3 269982a_100000225831_100000031795 [0,1,0,0,0,1|1,0,0]=3 387 B25R3.57381326 C#CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100000038162 [0,2,0,0,0,0|1,0,1]=4 388 B25R3.57381326 C#CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100000184674 [0,2,0,0,0,0|1,0,1]=4 389 B25R3.57381326 C=CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100000210623 [0,2,0,0,0,0|1,0,1]=4 390 B25R3.57381326 C=CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100000210623 [0,2,0,0,0,0|1,0,1]=4 391 B25R3.57381326 C=CCN(C)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100015514636 [0,2,0,0,0,0|1,0,1]=4 392 B25R3.57381326 CCCN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100000210303 [0,2,0,0,0,0|1,0,1]=4 393 B25R3.57381326 CCCN(C)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100000210303 [0,2,0,0,0,0|1,0,1]=4 394 B25R3.57381326 CCCN(C)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100000210303 [0,2,0,0,0,0|1,0,1]=4 395 B25R3.57381326 CN(CC#N)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100011215382 [0,2,0,0,0,0|1,0,1]=4 396 B25R3.57381326 CN(CC#N)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100011214920 [0,2,0,0,0,0|1,0,1]=4 397 B25R3.57381326 CN(CC=O)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_200015260668 [0,2,0,0,0,0|1,0,1]=4 398 B25R3.57381326 CN(CC=O)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_200015260668 [0,2,0,0,0,0|1,0,1]=4 399 B25R3.57381326 CN(CC=O)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_200009817547 [0,2,0,0,0,0|1,0,1]=4 400 B25R3.57381326 CN(CCF)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100011217306 [0,2,0,0,0,0|1,0,1]=4 401 B25R3.57381326 CN(CCF)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100011217306 [0,2,0,0,0,0|1,0,1]=4 402 B25R3.57381326 CN(CCF)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100011217306 [0,2,0,0,0,0|1,0,1]=4 403 B25R3.57381326 CN(CCO)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100000211926 [0,2,0,0,0,0|1,0,1]=4 404 B25R3.57381326 CN(CCO)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100000211926 [0,2,0,0,0,0|1,0,1]=4 405 B25R3.57381326 CN(CCO)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100000211926 [0,2,0,0,0,0|1,0,1]=4 406 B25R3.57381326 COCN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100000766300 [0,2,0,0,0,0|1,0,1]=4 407 B25R3.57381326 COCN(C)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100000766300 [0,2,0,0,0,0|1,0,1]=4 408 B25R3.57381326 CSCN(C)CCC=C1c2ccccc2CCc3c1cccc3 2230a_100000735373_100011218213 [0,2,0,0,0,0|1,0,1]=4 409 B25R3.57381326 CSCN(C)CCC=C1c2ccccc2CCc3c1cccc3 269982a_100000735373_100011218213 [0,2,0,0,0,0|1,0,1]=4 410 B25R3.57381326 CSCN(C)CCC=C1c2ccccc2CCc3c1cccc3 34a_100000735373_100011218213 [0,2,0,0,0,0|1,0,1]=4 411 B25R3.58350220 CCN(C)C(C)COC1c2ccccc2CCc3c1cccc3 7a_100000732741_100000031795 [0,2,0,0,0,0|2,0,0]=4 412 B25R3.123138604 CCN(CC)CCNC1c2ccccc2CCc3c1cccc3 2230a_100015382049_100000031795 [0,2,0,0,0,0|2,0,0]=4 413 B25R3.123138604 CCN(CC)CCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100000700428 [0,2,0,0,0,0|2,0,0]=4 414 B25R3.123138604 CCN(CC)CCOC1c2ccccc2CCc3c1cccc3 7a_100016990331_100000031795 [0,2,0,0,0,0|2,0,0]=4 415 B25R3.129016596 CCN(C)CCC(=O)N1c2ccccc2CCc3c1cccc3 2230a_100000225621_200020598663 [0,2,0,0,0,0|0,0,1]=3 416 B25R3.129016596 CCN(C)CCC(=O)N1c2ccccc2CCc3c1cccc3 269982a_100000225621_200020598663 [0,2,0,0,0,0|0,0,1]=3 417 B25R3.256813434 CCN(CCN(C)C)C1c2ccccc2CCc3c1cccc3 269982a_100000225870_100000031795 [0,2,0,0,0,0|2,0,0]=4 418 B25R3.231540767 CN(C)CC(C)(C)NC1c2ccccc2CCc3c1cccc3 2230a_100015183317_100000031795 [0,2,0,0,0,0|2,0,0]=4 419 B23R3.15257 CN1CCC(C1)Nc2ccccc2COc3ccccc3 7a_100000742786_200012183744 [0,0,1,1,0,0|1,0,0]=3 420 B23R3.15257 CN1CCC(C1)Nc2ccccc2SCc3ccccc3 7a_100000198535_200012183744 [0,0,1,1,0,0|1,0,0]=3 421 B23R3.15257 CN1CCC(C1)Oc2ccccc2OCc3ccccc3 7a_100000187230_200012183744 [0,0,1,1,0,0|2,0,0]=4 422 B23R3.15257 CN1CCC(C1)Sc2ccccc2OCc3ccccc3 62a_100000151716_200012183744 [0,0,1,1,0,0|2,0,0]=4 423 B23R3.16294 CC1CCCN(C1)c2ccccc2NCc3ccccc3 207a_100025718343_100015611070 [0,0,1,1,0,0|2,0,0]=4 424 B23R3.16294 CC1CCCN(C1)c2ccccc2NCc3ccccc3 2230a_100025718343_100015291786 [0,0,1,1,0,0|2,0,0]=4 425 B23R3.16294 CC1CCCN(C1)c2ccccc2NCc3ccccc3 270302a_100025718343_100015611070 [0,0,1,1,0,0|2,0,0]=4 426 B23R3.16294 CC1CCCN(C1)c2ccccc2NCc3ccccc3 34a_100025718343_100015291786 [0,0,1,1,0,0|2,0,0]=4 427 B23R3.49764 CN(C)CCN1CCc2ccccc2[C@@H]1c3ccccc3 269982a_100010197342_100000755713 [0,0,1,1,0,0|2,0,0]=4 428 B25R4.17937559 CN1CCC(C1)OC2c3ccccc3CCc4c2cccc4 7a_100000025823_200012183744 [0,0,0,1,0,1|1,0,0]=3 429 B25R4.17937559 CN1CCC(C1)OC2c3ccccc3CSc4c2cccc4 7a_100025745337_200012183744 [0,0,0,1,0,1|2,0,0]=4 430 B25R4.18463788 C[C@H]1CCCN(C1)C2c3ccccc3CCc4c2cccc4 2230a_100000717927_100000031795 [0,0,0,1,0,1|2,0,0]=4 431 B25R4.18463788 C[C@H]1CCCN(C1)C2c3ccccc3CCc4c2cccc4 269982a_100000717927_100000031795 [0,0,0,1,0,1|2,0,0]=4 432 B25R4.1799176503 CC1(CCCN1C2c3ccccc3CCc4c2cccc4)C 2230a_100000761399_100000031795 [0,0,0,1,0,1|2,0,0]=4 433 B25R4.1799176503 CC1(CCCN1C2c3ccccc3CCc4c2cccc4)C 269982a_100000761399_100000031795 [0,0,0,1,0,1|2,0,0]=4 434 B25R4.1877060028 CC1(CC1COC2c3ccccc3CCc4c2cccc4)C 7a_100000728257_100000031795 [0,0,0,1,0,1|2,0,0]=4 435 B25R4.17983575 CN1CCN(CC1)C2c3ccccc3CCc4c2cccc4 2230a_100000188432_100000031795 [0,1,0,1,0,0|2,0,0]=4 436 B25R4.17983575 CN1CCN(CC1)C2c3ccccc3CCc4c2cccc4 269982a_100000188432_100000031795 [0,1,0,1,0,0|2,0,0]=4 437 B25R4.81640806 CCN1CC(C1)NC2c3ccccc3CCc4c2cccc4 2230a_200015199589_100000031795 [0,1,0,1,0,0|2,0,0]=4 438 B25R4.439435775 CN(C)C1CN(C1)C2c3ccccc3CCc4c2cccc4 269982a_100000694738_100000031795 [0,1,0,1,0,0|2,0,0]=4 439 B21R2.12800 CC(=CCCNc1ccccc1Cc2ccccc2)C 2230a_100000211252_100011217483 [0,0,1,0,1,0|1,0,1]=4 440 B21R2.12800 CC(=CCCNc1ccccc1Cc2ccccc2)C 34a_100000211252_100011217483 [0,0,1,0,1,0|1,0,1]=4 441 B21R2.12800 CC(=CCCNc1ccccc1Cc2ccccc2)C 7a_100000211252_100011217483 [0,0,1,0,1,0|1,0,1]=4 442 B21R2.12800 CC(=O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000685027 [0,0,1,0,1,0|2,0,0]=4 443 B21R2.12800 CC(=O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215641 [0,0,1,0,1,0|2,0,0]=4 444 B21R2.12800 CC(C)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011214892 [0,0,1,0,1,0|1,0,0]=3 445 B21R2.12800 CC(C)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011214892 [0,0,1,0,1,0|1,0,0]=3 446 B21R2.12800 CC(C)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011214892 [0,0,1,0,1,0|1,0,0]=3 447 B21R2.12800 CC(C)CCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011214892 [0,0,1,0,1,0|2,0,0]=4 448 B21R2.12800 CC(C)CCCNc1ccccc1Oc2ccccc2 34a_100000182328_100011214892 [0,0,1,0,1,0|2,0,0]=4 449 B21R2.12800 CC(C)CCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011214892 [0,0,1,0,1,0|2,0,0]=4 450 B21R2.12800 CC(C)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011214892 [0,0,1,0,1,0|2,0,0]=4 451 B21R2.12800 CC(C)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011214892 [0,0,1,0,1,0|2,0,0]=4 452 B21R2.12800 CC(C)CCCSc1ccccc1Cc2ccccc2 62a_100011214892_200011216382 [0,0,1,0,1,0|2,0,0]=4 453 B21R2.12800 CC(C)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011214892 [0,0,1,0,1,0|2,0,0]=4 454 B21R2.12800 CC(C)OCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000211751 [0,0,1,0,1,0|2,0,0]=4 455 B21R2.12800 CC(C)OCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000211751 [0,0,1,0,1,0|2,0,0]=4 456 B21R2.12800 CC(C)OCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000211751 [0,0,1,0,1,0|2,0,0]=4 457 B21R2.12800 CC(C)SCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000730970 [0,0,1,0,1,0|2,0,0]=4 458 B21R2.12800 CC(C)SCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000730970 [0,0,1,0,1,0|2,0,0]=4 459 B21R2.12800 CC(C)SCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000730970 [0,0,1,0,1,0|2,0,0]=4 460 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_200000718107 [0,0,1,0,1,0|2,0,0]=4 461 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_200000718107 [0,0,1,0,1,0|2,0,0]=4 462 B21R2.12800 CC(O)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_200000718107 [0,0,1,0,1,0|2,0,0]=4 463 B21R2.12800 CN(C)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000757444 [0,0,1,0,1,0|0,0,0]=2 464 B21R2.12800 CN(C)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000757444 [0,0,1,0,1,0|1,0,0]=3 465 B21R2.12800 CN(C)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000757444 [0,0,1,0,1,0|2,0,0]=4 466 B21R2.12800 CN(C)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000757444 [0,0,1,0,1,0|1,0,0]=3 467 B21R2.12800 CN(C)CCNCc1ccccc1Cc2ccccc2 207a_100000210585_100009842342 [0,0,1,0,1,0|2,0,0]=4 468 B21R2.12800 CN(C)CCNCc1ccccc1Cc2ccccc2 270004a_100000210585_100009842342 [0,0,1,0,1,0|2,0,0]=4 469 B21R2.12800 CN(C)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000755713 [0,0,1,0,1,0|2,0,0]=4 470 B21R2.13007 CC(C)CCNc1ccccc1CCc2ccccn2 34a_200000071813_100000210312 [0,0,1,0,1,0|2,0,0]=4 471 B21R2.13007 CC(C)CCNc1ccccc1COc2ccccc2 2230a_100000742786_100000210312 [0,0,1,0,1,0|2,0,0]=4 472 B21R2.13007 CC(C)CCNc1ccccc1COc2ccccc2 34a_100000742786_100000210312 [0,0,1,0,1,0|2,0,0]=4 473 B21R2.13007 CC(C)CCNc1ccccc1COc2ccccc2 7a_100000742786_100000210626 [0,0,1,0,1,0|2,0,0]=4 474 B21R2.13007 CC(C)CCNc1ccccc1OCc2ccccc2 34a_100011193923_100000210312 [0,0,1,0,1,0|2,0,0]=4 475 B21R2.13007 CC(C)CCNc1ccccc1SCc2ccccc2 34a_100000198535_100000210312 [0,0,1,0,1,0|2,0,0]=4 476 B21R2.13007 CC(C)CCNc1ccccc1SCc2ccccc2 7a_100000198535_100000210626 [0,0,1,0,1,0|2,0,0]=4 477 B21R2.13007 CC(C)COCc1ccccc1CCc2ccccc2 34a_200000042600_100000210624 [0,0,1,0,1,0|2,0,0]=4 478 B21R2.13007 CC(C)COCc1ccccc1CCc2ccccc2 7a_200000042600_100000210760 [0,0,1,0,1,0|2,0,0]=4 479 B21R2.13007 CN(C)CCNc1ccccc1COc2ccccc2 7a_100000742786_100000755713 [0,0,1,0,1,0|1,0,0]=3 480 B21R2.13007 CN(C)CCNc1ccccc1SCc2ccccc2 7a_100000198535_100000755713 [0,0,1,0,1,0|1,0,0]=3 481 B21R2.13007 CN(C)CCOc1ccccc1CNc2ccccc2 207a_100000106764_200011232682 [0,0,1,0,1,0|2,0,0]=4 482 B21R2.13007 CN(C)CCOc1ccccc1CNc2ccccc2 270302a_100000106764_200011232682 [0,0,1,0,1,0|2,0,0]=4 483 B21R2.13007 CN(C)CCOc1ccccc1OCc2ccccc2 7a_100000187230_100000755713 [0,0,1,0,1,0|2,0,0]=4 484 B21R2.13007 CN(C)CCOc1ccccc1SCc2ccccc2 62a_100000211182_100102946404 [0,0,1,0,1,0|2,0,0]=4 485 B21R2.13007 CN(C)CCOc1ccccc1SCc2ccccc2 62a_100102946404_100015291786 [0,0,1,0,1,0|2,0,0]=4 486 B21R2.13007 CN(C)CCSc1ccccc1OCc2ccccc2 62a_100000151716_100000755713 [0,0,1,0,1,0|2,0,0]=4 487 B21R2.253117 CN(C)CCCNc1ccccc1SCc2ccsc2 7a_100000218815_100000757444 [0,0,1,0,1,0|2,0,0]=4 488 B21R3.9913503 CC(C)OCCn1c2ccccc2c3c1cccc3 34a_100000297428_100000210206 [0,0,0,0,2,0|2,0,0]=4 489 B21R3.9913503 CN(C)CCOC1c2ccccc2-c3c1cccc3 7a_100000211495_100000755713 [0,0,0,0,2,0|2,0,0]=4 490 B21R3.9913503 CN(C)CCSC1c2ccccc2-c3c1cccc3 62a_100000211598_100000755713 [0,0,0,0,2,0|2,0,0]=4 491 B23R2.186861 CC(C)CCCCNc1ccccc1CCc2ccccn2 34a_200000071813_100011216152 [0,0,1,0,0,1|2,0,0]=4 492 B23R2.186861 CC(C)CCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100011216152 [0,0,1,0,0,1|2,0,0]=4 493 B23R2.186861 CC(C)CCCCNc1ccccc1COc2ccccc2 34a_100000742786_100011216152 [0,0,1,0,0,1|2,0,0]=4 494 B23R2.186861 CC(C)CCCCNc1ccccc1COc2ccccc2 7a_100000742786_100011216152 [0,0,1,0,0,1|2,0,0]=4 495 B23R2.186861 CC(C)CCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100011216152 [0,0,1,0,0,1|2,0,0]=4 496 B23R2.186861 CC(C)CCCNCc1ccccc1COc2ccccc2 34a_100000737599_100011214892 [0,0,1,0,0,1|2,0,0]=4 497 B23R2.186861 CC(C)CCCNCc1ccccc1OCc2ccccc2 207a_200000737386_100000151772 [0,0,1,0,0,1|2,0,0]=4 498 B23R2.186861 CC(C)CCCNCc1ccccc1OCc2ccccc2 270004a_200000737386_100000151772 [0,0,1,0,0,1|2,0,0]=4 499 B23R2.186861 CC(C)CCCNCc1ccccc1OCc2ccccc2 34a_100000741334_100011214892 [0,0,1,0,0,1|2,0,0]=4 500 B23R2.186861 CC(C)CCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100011214892 [0,0,1,0,0,1|2,0,0]=4 501 B23R2.186861 CC(C)CCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100011214892 [0,0,1,0,0,1|2,0,0]=4 502 B23R2.186861 CN(C)CCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000690147 [0,0,1,0,0,1|2,0,0]=4 503 B23R2.186861 CN(C)CCCNCc1ccccc1C#Cc2ccccc2 207a_102531767803_100000069009 [0,0,1,0,0,1|0,0,2]=4 504 B23R2.186861 CN(C)CCCNCc1ccccc1OCc2ccccc2 207a_102531767803_100000151772 [0,0,1,0,0,1|1,0,0]=3 505 B23R2.186861 CN(C)CCCNCc1ccccc1OCc2ccccc2 270004a_102531767803_100000151772 [0,0,1,0,0,1|1,0,0]=3 506 B23R2.186861 CN(C)CCCNCc1ccccc1OCc2ccccn2 207a_102531767803_100000735654 [0,0,1,0,0,1|2,0,0]=4 507 B23R2.186861 CN(C)CCCNCc1ccccc1OCc2ccccn2 270004a_102531767803_100000735654 [0,0,1,0,0,1|2,0,0]=4 508 B23R2.186861 CN(C)CCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000757444 [0,0,1,0,0,1|1,0,0]=3 509 B23R2.186861 CN(C)CCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000757444 [0,0,1,0,0,1|2,0,0]=4 510 B23R2.186861 CN(C)CCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000755713 [0,0,1,0,0,1|2,0,0]=4 511 B23R2.468396 CC(C)CCCNc1ccccc1OCCc2ccccn2 34a_200015185306_100011214892 [0,0,1,0,0,1|2,0,0]=4 512 B23R2.468396 CC(C)CCCOc1ccccc1CNCc2ccccc2 34a_100011219060_100011214892 [0,0,1,0,0,1|2,0,0]=4 513 B23R2.468396 CC(C)CCCSc1ccccc1CNCc2ccccc2 62a_100011214892_200000195884 [0,0,1,0,0,1|2,0,0]=4 514 B23R2.468396 CC(C)CCCSc1ccccc1CNCc2ccccc2 62a_200000195884_100011214892 [0,0,1,0,0,1|2,0,0]=4 515 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccc2 207a_100015324214_100015183612 [0,0,1,0,0,1|1,0,0]=3 516 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccc2 207a_200011280557_100015611070 [0,0,1,0,0,1|1,0,0]=3 517 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccc2 270004a_100015324214_100015183612 [0,0,1,0,0,1|1,0,0]=3 518 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccc2 270004a_200011280557_100015611070 [0,0,1,0,0,1|1,0,0]=3 519 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccn2 207a_200011280557_100000209966 [0,0,1,0,0,1|2,0,0]=4 520 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccn2 270004a_100000210449_100015183612 [0,0,1,0,0,1|2,0,0]=4 521 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccccn2 270004a_200011280557_100000209966 [0,0,1,0,0,1|2,0,0]=4 522 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2cccnc2 207a_100000210453_100015183612 [0,0,1,0,0,1|2,0,0]=4 523 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2cccnc2 207a_200011280557_100000209961 [0,0,1,0,0,1|2,0,0]=4 524 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2cccnc2 270004a_100000210453_100015183612 [0,0,1,0,0,1|2,0,0]=4 525 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2cccnc2 270004a_200011280557_100000209961 [0,0,1,0,0,1|2,0,0]=4 526 B23R2.468396 CN(C)CCCOc1ccccc1CNCc2ccncc2 207a_200011280557_100000186114 [0,0,1,0,0,1|2,0,0]=4 527 B23R2.468396 CN(C)CCCSc1ccccc1CNCc2ccccc2 62a_200000195884_100000757444 [0,0,1,0,0,1|1,0,0]=3 528 B23R2.102545 CN(C)CCCN(Cc1ccccc1)c2ccccc2C#N 269982a_100000218953_100000757444 [0,0,1,0,0,1|1,0,1]=4 529 B23R2.838824 COc1ccccc1C(NCCCN(C)C)c2ccccc2 270004a_102531767803_100011218802 [0,0,1,0,0,1|2,0,0]=4 530 B23R2.6001348 CN(C)CCCN(Cc1ccccc1F)c2ccccc2F 269982a_100000277451_100000757444 [0,0,1,0,0,1|2,0,0]=4 531 B23R3.19159989 CN(C)CCCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000757444 [0,0,0,0,1,1|2,0,0]=4 532 B23R3.19159989 CN(C)CCCSc1c2ccccc2nc3c1cccc3 62a_100000044299_100000757444 [0,0,0,0,1,1|2,0,0]=4 533 B23R3.19159989 CN(C)CCNCc1c2ccccc2cc3c1cccc3 207a_100000210585_100000261405 [0,0,0,0,1,1|1,0,1]=4 534 B23R3.19159989 CN(C)CCNCc1c2ccccc2cc3c1cccc3 270004a_100000210585_100000261405 [0,0,0,0,1,1|1,0,1]=4 535 B23R3.19159989 CN(C)CCOCc1c2ccccc2cc3c1cccc3 7a_100000025838_100000755713 [0,0,0,0,1,1|1,0,1]=4 536 B23R3.19159989 CN(C)CCSCc1c2ccccc2cc3c1cccc3 62a_100009992879_100000755713 [0,0,0,0,1,1|1,0,1]=4 537 B23R3.19159989 CN(C)CCSCc1c2ccccc2nc3c1cccc3 62a_100009813545_100000755713 [0,0,0,0,1,1|2,0,0]=4 538 B25R3.32227889 CC(C)CCCCOC1c2ccccc2CCc3c1cccc3 34a_100000025823_100011216152 [0,0,0,0,0,2|2,0,0]=4 539 B25R3.32227889 CC(C)CCCCOC1c2ccccc2CCc3c1cccc3 7a_100000025823_100011216152 [0,0,0,0,0,2|2,0,0]=4 540 B25R3.32227889 CC(C)CCCCOC1c2ccccc2CCc3c1cccc3 7a_100011214890_100000031795 [0,0,0,0,0,2|2,0,0]=4 541 B25R3.32227889 CC(C)COCCOC1c2ccccc2CCc3c1cccc3 7a_100000703358_100000031795 [0,0,0,0,0,2|2,0,0]=4 542 B25R3.32227889 CC(C)CSCCOC1c2ccccc2CCc3c1cccc3 7a_200000230437_100000031795 [0,0,0,0,0,2|2,0,0]=4 543 B25R3.32227889 CC(C)OCCCNC1c2ccccc2CCc3c1cccc3 2230a_100000737246_100000031795 [0,0,0,0,0,2|2,0,0]=4