0 B16R3.1795 c1ccc(cc1)c2n[nH]c3c2CCC3 271570a_100011218836_100010892149 [0,0,0,0,0,0|1,0,3]=4 1 B15R2.66 CCCN1CCC(C1)c2ccccc2 2230a_100000747531_100000210303 [0,0,1,0,0,0|2,0,0]=3 2 B15R2.66 CCCN1CCC(C1)c2ccccc2 269982a_100000747531_100000210303 [0,0,1,0,0,0|2,0,0]=3 3 B15R2.66 CCCN1CCC(C1)c2ccccc2 34a_100000747531_100000210303 [0,0,1,0,0,0|2,0,0]=3 4 B15R2.66 CCCN1CCC(C1)c2ccccn2 2230a_100102730755_100000210303 [0,0,1,0,0,0|3,0,0]=4 5 B15R2.66 CCCN1CCC(C1)c2ccccn2 269982a_100102730755_100000210303 [0,0,1,0,0,0|3,0,0]=4 6 B15R2.66 CCCN1CCC(C1)c2cccnc2 2230a_200015204282_100000210303 [0,0,1,0,0,0|3,0,0]=4 7 B15R2.66 CCCN1CCC(C1)c2cccnc2 269982a_200015204282_100000210303 [0,0,1,0,0,0|3,0,0]=4 8 B15R2.66 CCNC1CCC(C1)c2ccccc2 270004a_100015525214_100000750937 [0,0,1,0,0,0|2,0,0]=3 9 B15R2.66 COCC1CCN(C1)c2ccccc2 34a_100000758375_200000210301 [0,0,1,0,0,0|3,0,0]=4 10 B15R2.66 COCC1CCN(C1)c2ccccc2 7a_100000758375_200000210301 [0,0,1,0,0,0|3,0,0]=4 11 B15R2.66 COCN1CCC(C1)c2ccccc2 2230a_100000747531_100000766300 [0,0,1,0,0,0|3,0,0]=4 12 B15R2.66 COCN1CCC(C1)c2ccccc2 269982a_100000747531_100000766300 [0,0,1,0,0,0|3,0,0]=4 13 B15R2.66 CSCN1CCC(C1)c2ccccc2 2230a_100000747531_100011218213 [0,0,1,0,0,0|3,0,0]=4 14 B15R2.66 CSCN1CCC(C1)c2ccccc2 269982a_100000747531_100011218213 [0,0,1,0,0,0|3,0,0]=4 15 B15R2.66 CSCN1CCC(C1)c2ccccc2 34a_100000747531_100011218213 [0,0,1,0,0,0|3,0,0]=4 16 B15R2.66 FCCN1CCC(C1)c2ccccc2 2230a_100000747531_100011217306 [0,0,1,0,0,0|3,0,0]=4 17 B15R2.66 FCCN1CCC(C1)c2ccccc2 269982a_100000747531_100011217306 [0,0,1,0,0,0|3,0,0]=4 18 B15R2.66 FCCN1CCC(C1)c2ccccc2 34a_100000747531_100011217306 [0,0,1,0,0,0|3,0,0]=4 19 B15R2.66 OCCN1CCC(C1)c2ccccc2 2230a_100000747531_100000211926 [0,0,1,0,0,0|3,0,0]=4 20 B15R2.66 OCCN1CCC(C1)c2ccccc2 269982a_100000747531_100000211926 [0,0,1,0,0,0|3,0,0]=4 21 B15R2.66 OCCN1CCC(C1)c2ccccc2 34a_100000747531_100000211926 [0,0,1,0,0,0|3,0,0]=4 22 B15R2.66 [13CH3]OCC1CCN(C1)c2ccccc2 34a_100000758375_200025704644 [0,0,1,0,0,0|3,0,0]=4 23 B15R2.66 [13CH3]OCC1CCN(C1)c2ccccc2 7a_100000758375_200025704644 [0,0,1,0,0,0|3,0,0]=4 24 B15R2.72 CCCN1CCCC1c2ccccc2 2230a_100000243309_100000210303 [0,0,1,0,0,0|2,0,0]=3 25 B15R2.72 CCCN1CCCC1c2ccccc2 269982a_100000243309_100000210303 [0,0,1,0,0,0|2,0,0]=3 26 B15R2.72 CCCN1CCCC1c2ccccc2 34a_100000243309_100000210303 [0,0,1,0,0,0|2,0,0]=3 27 B15R2.72 CCCN1CCCC1c2ccccn2 2230a_100000744244_100000210303 [0,0,1,0,0,0|3,0,0]=4 28 B15R2.72 CCCN1CCCC1c2ccccn2 269982a_100000744244_100000210303 [0,0,1,0,0,0|3,0,0]=4 29 B15R2.72 CCCN1CCCC1c2cccnc2 2230a_100000233489_100000210303 [0,0,1,0,0,0|3,0,0]=4 30 B15R2.72 CCCN1CCCC1c2cccnc2 269982a_100000233489_100000210303 [0,0,1,0,0,0|3,0,0]=4 31 B15R2.72 CCCN1CCCC1c2ccncc2 2230a_106446545576_100000210303 [0,0,1,0,0,0|3,0,0]=4 32 B15R2.72 CCCN1CCCC1c2ccncc2 269982a_106446545576_100000210303 [0,0,1,0,0,0|3,0,0]=4 33 B15R2.72 CCCN1CCSC1c2ccccc2 2230a_100000215944_100000210303 [0,0,1,0,0,0|3,0,0]=4 34 B15R2.72 CCCN1CCSC1c2ccccc2 269982a_100000215944_100000210303 [0,0,1,0,0,0|3,0,0]=4 35 B15R2.72 CCCN1CCSC1c2ccccc2 34a_100000215944_100000210303 [0,0,1,0,0,0|3,0,0]=4 36 B15R2.72 CCCN1CCSC1c2ccccc2 7a_100000215944_100000210303 [0,0,1,0,0,0|3,0,0]=4 37 B15R2.72 CCN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100000210202 [0,0,1,0,0,0|2,0,0]=3 38 B15R2.72 CCN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100000210202 [0,0,1,0,0,0|2,0,0]=3 39 B15R2.72 CCOC1COCC1c2ccccc2 34a_100010739164_100000210202 [0,0,1,0,0,0|2,0,0]=3 40 B15R2.72 CCOC1COCC1c2ccccc2 7a_100010739164_100000210202 [0,0,1,0,0,0|2,0,0]=3 41 B15R2.72 COCN1CCCC1c2ccccc2 2230a_100000243309_100000766300 [0,0,1,0,0,0|3,0,0]=4 42 B15R2.72 COCN1CCCC1c2ccccc2 269982a_100000243309_100000766300 [0,0,1,0,0,0|3,0,0]=4 43 B15R2.72 CSCN1CCCC1c2ccccc2 2230a_100000243309_100011218213 [0,0,1,0,0,0|3,0,0]=4 44 B15R2.72 CSCN1CCCC1c2ccccc2 269982a_100000243309_100011218213 [0,0,1,0,0,0|3,0,0]=4 45 B15R2.72 CSCN1CCCC1c2ccccc2 34a_100000243309_100011218213 [0,0,1,0,0,0|3,0,0]=4 46 B15R2.72 FCCN1CCCC1c2ccccc2 2230a_100000243309_100011217306 [0,0,1,0,0,0|3,0,0]=4 47 B15R2.72 FCCN1CCCC1c2ccccc2 269982a_100000243309_100011217306 [0,0,1,0,0,0|3,0,0]=4 48 B15R2.72 FCCN1CCCC1c2ccccc2 34a_100000243309_100011217306 [0,0,1,0,0,0|3,0,0]=4 49 B15R2.72 FCN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100015361967 [0,0,1,0,0,0|3,0,0]=4 50 B15R2.72 FCOC1COCC1c2ccccc2 34a_100010739164_100015361967 [0,0,1,0,0,0|3,0,0]=4 51 B15R2.72 FCOC1COCC1c2ccccc2 7a_100010739164_100015361967 [0,0,1,0,0,0|3,0,0]=4 52 B15R2.72 OCCN1CCCC1c2ccccc2 2230a_100000243309_100000211926 [0,0,1,0,0,0|3,0,0]=4 53 B15R2.72 OCCN1CCCC1c2ccccc2 269982a_100000243309_100000211926 [0,0,1,0,0,0|3,0,0]=4 54 B15R2.72 OCCN1CCCC1c2ccccc2 34a_100000243309_100000211926 [0,0,1,0,0,0|3,0,0]=4 55 B15R2.118 CCC1CCCN1Cc2ccccc2 2230a_100000754278_100015291786 [0,0,1,0,0,0|2,0,0]=3 56 B15R2.118 CCC1CCCN1Cc2ccccc2 269982a_100000754278_100000211182 [0,0,1,0,0,0|2,0,0]=3 57 B15R2.118 CCC1CCCN1Cc2ccccc2 270004a_100000754278_100015611070 [0,0,1,0,0,0|2,0,0]=3 58 B15R2.118 CCC1CCCN1Cc2ccccc2 34a_100000754278_100015291786 [0,0,1,0,0,0|2,0,0]=3 59 B15R2.118 CCC1CCCN1Cc2ccccn2 2230a_100000754278_100000721315 [0,0,1,0,0,0|3,0,0]=4 60 B15R2.118 CCC1CCCN1Cc2ccccn2 269982a_100000754278_100000721315 [0,0,1,0,0,0|3,0,0]=4 61 B15R2.118 CCC1CCCN1Cc2ccccn2 270004a_100000754278_100000209966 [0,0,1,0,0,0|3,0,0]=4 62 B15R2.118 CCC1CCCN1Cc2ccccn2 34a_100000754278_100000721315 [0,0,1,0,0,0|3,0,0]=4 63 B15R2.118 CCC1CCCN1Cc2cccnc2 2230a_100000754278_100000741622 [0,0,1,0,0,0|3,0,0]=4 64 B15R2.118 CCC1CCCN1Cc2cccnc2 269982a_100000754278_100000733263 [0,0,1,0,0,0|3,0,0]=4 65 B15R2.118 CCC1CCCN1Cc2cccnc2 270004a_100000754278_100000209961 [0,0,1,0,0,0|3,0,0]=4 66 B15R2.118 CCC1CCCN1Cc2cccnc2 34a_100000754278_100000733263 [0,0,1,0,0,0|3,0,0]=4 67 B15R2.118 CCC1CCCN1Cc2ccncc2 2230a_100000754278_100015193705 [0,0,1,0,0,0|3,0,0]=4 68 B15R2.118 CCC1CCCN1Cc2ccncc2 269982a_100000754278_100015193705 [0,0,1,0,0,0|3,0,0]=4 69 B15R2.118 CCN1CCCC1Cc2ccccc2 2230a_100159249835_100000210202 [0,0,1,0,0,0|2,0,0]=3 70 B15R2.118 CCN1CCCC1Cc2ccccc2 269982a_100159249835_100000204670 [0,0,1,0,0,0|2,0,0]=3 71 B15R2.118 CCN1CCCC1Cc2ccccc2 34a_100159249835_100000210202 [0,0,1,0,0,0|2,0,0]=3 72 B15R2.118 CNC1CCCC1Cc2ccccc2 269862a_106832991636_200000757594 [0,0,1,0,0,0|0,0,0]=1 73 B15R2.118 CNC1CCCC1Cc2ccccc2 270004a_106832991635_200000757594 [0,0,1,0,0,0|0,0,0]=1 74 B15R2.118 FCN1CCCC1Cc2ccccc2 269982a_100159249835_100015361967 [0,0,1,0,0,0|3,0,0]=4 75 B15R2.118 FCN1CCCC1Cc2ccccc2 34a_100159249835_100015361967 [0,0,1,0,0,0|3,0,0]=4 76 B15R2.118 N#CC1CCCN1Cc2ccccc2 2230a_100000701862_100015291786 [0,0,1,0,0,0|3,0,0]=4 77 B15R2.118 N#C[C@H]1CCCN1Cc2ccccc2 2230a_106645074975_100015291786 [0,0,1,0,0,0|3,0,0]=4 78 B15R2.118 N#C[C@H]1CCCN1Cc2ccccc2 269982a_106645074975_100000211182 [0,0,1,0,0,0|3,0,0]=4 79 B15R2.118 N#C[C@H]1CCCN1Cc2ccccc2 270004a_106645074975_100015611070 [0,0,1,0,0,0|3,0,0]=4 80 B15R2.118 OC[C@H]1CCCN1Cc2ccccc2 2230a_100000745186_100015291786 [0,0,1,0,0,0|3,0,0]=4 81 B15R2.118 OC[C@H]1CCCN1Cc2ccccc2 269982a_100000745186_100000211182 [0,0,1,0,0,0|3,0,0]=4 82 B15R2.118 OC[C@H]1CCCN1Cc2ccccc2 270004a_100000745186_100015611070 [0,0,1,0,0,0|3,0,0]=4 83 B15R2.118 OC[C@H]1CCCN1Cc2ccccc2 34a_100000745186_100015291786 [0,0,1,0,0,0|3,0,0]=4 84 B15R2.131 C=CC(c1ccccc1)N2CCCC2 2230a_100000188435_200000085779 [0,0,1,0,0,0|2,0,1]=4 85 B15R2.131 C=CC(c1ccccc1)N2CCCC2 269982a_100000188435_200000085779 [0,0,1,0,0,0|2,0,1]=4 86 B15R2.131 CCN(c1ccccc1)C2CCCC2 2230a_100000210013_100000179811 [0,0,1,0,0,0|2,0,0]=3 87 B15R2.131 CCN(c1ccccc1)C2CCCC2 269982a_100000210013_100000179811 [0,0,1,0,0,0|2,0,0]=3 88 B15R2.131 CCN(c1ccccc1)C2CCCC2 34a_100000210013_100000179811 [0,0,1,0,0,0|2,0,0]=3 89 B15R2.131 CCN(c1ccccc1)C2CCOC2 2230a_100000210013_100000731011 [0,0,1,0,0,0|3,0,0]=4 90 B15R2.131 CCN(c1ccccc1)C2CCOC2 269982a_100000210013_100000731011 [0,0,1,0,0,0|3,0,0]=4 91 B15R2.131 CCN(c1ccccc1)C2CCOC2 34a_100000210013_100000690089 [0,0,1,0,0,0|3,0,0]=4 92 B15R2.131 CNC(c1ccccc1)C2CCCC2 2230a_100000746738_200000210301 [0,0,1,0,0,0|2,0,0]=3 93 B15R2.131 CNC(c1ccccc1)C2CCCC2 269862a_106832991636_100000753715 [0,0,1,0,0,0|2,0,0]=3 94 B15R2.131 CNC(c1ccccc1)C2CCCC2 34a_100000746738_200000210301 [0,0,1,0,0,0|2,0,0]=3 95 B15R2.131 CNC(c1ccccc1)C2CCNC2 269862a_106832991636_100015189469 [0,0,1,0,0,0|3,0,0]=4 96 B15R2.131 CNC(c1ccccn1)C2CCCC2 269862a_106832991636_100000764701 [0,0,1,0,0,0|3,0,0]=4 97 B15R2.131 [13CH3]NC(c1ccccc1)C2CCCC2 2230a_100000746738_200025704644 [0,0,1,0,0,0|2,0,0]=3 98 B15R2.131 [13CH3]NC(c1ccccc1)C2CCCC2 34a_100000746738_200025704644 [0,0,1,0,0,0|2,0,0]=3 99 B15R2.395 CC(c1ccccc1)N2CCC[C@@H]2C 2230a_100020605311_100000230085 [0,0,1,0,0,0|2,0,0]=3 100 B15R2.395 CC(c1ccccc1)N2CCC[C@@H]2C 269982a_100020605311_100000230085 [0,0,1,0,0,0|2,0,0]=3 101 B15R2.395 CC(c1ccccc1)N2CCC[C@H]2C 2230a_100015189458_100000230085 [0,0,1,0,0,0|2,0,0]=3 102 B15R2.395 CC(c1ccccc1)N2CCC[C@H]2C 269982a_100015189458_100000230085 [0,0,1,0,0,0|2,0,0]=3 103 B15R2.395 CC(c1ccccc1)N2CCC[C@H]2C 34a_100015189458_100000211855 [0,0,1,0,0,0|2,0,0]=3 104 B15R2.395 CC1SCCN1C(C)c2ccccc2 2230a_200011216479_100000230085 [0,0,1,0,0,0|3,0,0]=4 105 B15R2.395 CC1SCCN1C(C)c2ccccc2 269982a_200011216479_100000230085 [0,0,1,0,0,0|3,0,0]=4 106 B15R2.395 CC1SCCN1C(C)c2ccccc2 34a_200011216479_100000211855 [0,0,1,0,0,0|3,0,0]=4 107 B15R2.395 CN(c1ccccc1)C2CCCC2=O 2230a_100000210012_100000211823 [0,0,1,0,0,0|2,0,1]=4 108 B15R2.395 CN(c1ccccc1)C2CCCC2=O 269982a_100000210012_100000211823 [0,0,1,0,0,0|2,0,1]=4 109 B15R2.395 CN(c1ccccc1)C2CCCC2=O 34a_100000210012_100000709159 [0,0,1,0,0,0|2,0,1]=4 110 B15R2.395 CN(c1ccccc1)C2COCC2O 34a_100000210012_200000725654 [0,0,1,0,0,0|3,0,0]=4 111 B15R2.395 CN(c1ccccc1)[C@@H]2CCC[C@H]2O 269982a_100000210012_200016002552 [0,0,1,0,0,0|2,0,0]=3 112 B15R2.2196 C(#Cc1ccccc1)CC2CCCC2 271570a_200010126907_100000210277 [0,0,1,0,0,0|1,0,2]=4 113 B15R2.2196 C(=Cc1ccccc1)CC2CCCC2 271570a_200000069456_100000210277 [0,0,1,0,0,0|1,0,2]=4 114 B15R2.2196 C(=NNC1CCCC1)c2ccccc2 4a_100000737850_100015611070 [0,0,1,0,0,0|1,0,1]=3 115 B15R2.2196 C(=NNC1CCCC1)c2ccccn2 4a_100000737850_100000209966 [0,0,1,0,0,0|2,0,1]=4 116 B15R2.2196 C(=NNC1CCCC1)c2cccnc2 4a_100000737850_100000209961 [0,0,1,0,0,0|2,0,1]=4 117 B15R2.2196 C(=NNC1CCCC1)c2ccncc2 4a_100000737850_100000186114 [0,0,1,0,0,0|2,0,1]=4 118 B15R2.2196 C(=NNC1CCOC1)c2ccccc2 4a_100000690549_100015611070 [0,0,1,0,0,0|2,0,1]=4 119 B15R2.2196 C(=NNC1CCSC1)c2ccccc2 4a_200000731317_100015611070 [0,0,1,0,0,0|2,0,1]=4 120 B15R2.2196 C(=NNc1ccccc1)C2CCCC2 4a_100015195140_100000746403 [0,0,1,0,0,0|3,0,0]=4 121 B15R2.2196 C1=CCC(C1)NCCc2ccccc2 2230a_100015188752_100000765856 [0,0,1,0,0,0|0,0,2]=3 122 B15R2.2196 C1=CCC(C1)NCCc2ccccn2 2230a_100015188752_100015183660 [0,0,1,0,0,0|1,0,2]=4 123 B15R2.2196 C1=CCC(C1)NCCc2cccnc2 2230a_100015188752_200011713674 [0,0,1,0,0,0|1,0,2]=4 124 B15R2.2196 C1=CCC(C1)NCCc2ccncc2 2230a_100015188752_100000723409 [0,0,1,0,0,0|1,0,2]=4 125 B15R2.2196 C1=CCC(C1)NCSc2ccccc2 2230a_100015188752_100011218342 [0,0,1,0,0,0|1,0,2]=4 126 B15R2.2196 c1cc(ccn1)CCNC2CCCC2 2230a_100000211070_100000723409 [0,0,1,0,0,0|1,0,0]=2 127 B15R2.2196 c1cc(ccn1)CCNC2CCCC2 270004a_100000742849_100000210133 [0,0,1,0,0,0|1,0,0]=2 128 B15R2.2196 c1cc(ccn1)CCNC2CCOC2 270004a_100000742849_100000752484 [0,0,1,0,0,0|2,0,0]=3 129 B15R2.2196 c1cc(ccn1)CCNC2CCSC2 270004a_100000742849_100000212027 [0,0,1,0,0,0|2,0,0]=3 130 B15R2.2196 c1cc(ccn1)CCN[C@@H]2CCOC2 2230a_200015188469_100000723409 [0,0,1,0,0,0|2,0,0]=3 131 B15R2.2196 c1cc(ccn1)CCN[C@H]2CCOC2 2230a_100015188467_100000723409 [0,0,1,0,0,0|2,0,0]=3 132 B15R2.2196 c1cc(ccn1)CCOC2CCCC2 34a_100011216225_100000179811 [0,0,1,0,0,0|2,0,0]=3 133 B15R2.2196 c1cc(ccn1)CCOC2CCCC2 7a_100000210269_100000723409 [0,0,1,0,0,0|2,0,0]=3 134 B15R2.2196 c1cc(ccn1)CCOC2CCOC2 34a_100011216225_100000690089 [0,0,1,0,0,0|3,0,0]=4 135 B15R2.2196 c1cc(ccn1)CCOC2CCSC2 7a_100011232664_100000723409 [0,0,1,0,0,0|3,0,0]=4 136 B15R2.2196 c1cc(ccn1)CCSC2CCCC2 62a_100000723409_100000179811 [0,0,1,0,0,0|2,0,0]=3 137 B15R2.2196 c1cc(ccn1)CCSC2CCCC2 62a_100011217020_100000723409 [0,0,1,0,0,0|2,0,0]=3 138 B15R2.2196 c1cc(ccn1)CCSC2CCOC2 62a_100000723409_100000690089 [0,0,1,0,0,0|3,0,0]=4 139 B15R2.2196 c1cc(ccn1)CNCC2CCCC2 207a_100000737975_100000186114 [0,0,1,0,0,0|3,0,0]=4 140 B15R2.2196 c1cc(ccn1)CNCC2CCCC2 2230a_100000737975_100015193705 [0,0,1,0,0,0|3,0,0]=4 141 B15R2.2196 c1cc(ccn1)CNCC2CCCC2 269862a_100000210450_100000746403 [0,0,1,0,0,0|3,0,0]=4 142 B15R2.2196 c1cc(ccn1)COCC2CCCC2 7a_100000742336_100015193705 [0,0,1,0,0,0|3,0,0]=4 143 B15R2.2196 c1cc(ccn1)CSCC2CCCC2 62a_100000740388_100015193705 [0,0,1,0,0,0|3,0,0]=4 144 B15R2.2196 c1cc(ccn1)CSCC2CCCC2 62a_100015193705_100000740388 [0,0,1,0,0,0|3,0,0]=4 145 B15R2.2196 c1cc(ccn1)OCCC2CCCC2 34a_100000212176_100000760354 [0,0,1,0,0,0|3,0,0]=4 146 B15R2.2196 c1cc(ccn1)SCCC2CCCC2 62a_100000728582_100000760354 [0,0,1,0,0,0|3,0,0]=4 147 B15R2.2196 c1cc(ccn1)SCCC2CCCC2 62a_100000760354_100000728582 [0,0,1,0,0,0|3,0,0]=4 148 B15R2.2196 c1ccc(cc1)CCCN2CCCC2 2230a_100000188435_100000211621 [0,0,1,0,0,0|2,0,0]=3 149 B15R2.2196 c1ccc(cc1)CCCN2CCCC2 269982a_100000188435_100000211621 [0,0,1,0,0,0|2,0,0]=3 150 B15R2.2196 c1ccc(cc1)CCCN2CCSC2 2230a_100011215254_100000211621 [0,0,1,0,0,0|3,0,0]=4 151 B15R2.2196 c1ccc(cc1)CCCN2CCSC2 269982a_100011215254_100000211621 [0,0,1,0,0,0|3,0,0]=4 152 B15R2.2196 c1ccc(cc1)CCNC2CCCC2 2230a_100000106460_100000179811 [0,0,1,0,0,0|0,0,0]=1 153 B15R2.2196 c1ccc(cc1)CCNC2CCCC2 2230a_100000211070_100000765856 [0,0,1,0,0,0|0,0,0]=1 154 B15R2.2196 c1ccc(cc1)CCNC2CCCC2 270004a_100000106460_100000210133 [0,0,1,0,0,0|0,0,0]=1 155 B15R2.2196 c1ccc(cc1)CCNC2CCCC2 34a_100000106460_100000179811 [0,0,1,0,0,0|0,0,0]=1 156 B15R2.2196 c1ccc(cc1)CCNC2CCCC2 34a_100000211070_100000765856 [0,0,1,0,0,0|0,0,0]=1 157 B15R2.2196 c1ccc(cc1)CCNC2CCOC2 2230a_100000106460_100000731011 [0,0,1,0,0,0|1,0,0]=2 158 B15R2.2196 c1ccc(cc1)CCNC2CCOC2 270004a_100000106460_100000752484 [0,0,1,0,0,0|1,0,0]=2 159 B15R2.2196 c1ccc(cc1)CCNC2CCOC2 34a_100000106460_100000690089 [0,0,1,0,0,0|1,0,0]=2 160 B15R2.2196 c1ccc(cc1)CCNC2CCSC2 270004a_100000106460_100000212027 [0,0,1,0,0,0|1,0,0]=2 161 B15R2.2196 c1ccc(cc1)CCN[C@@H]2CCOC2 2230a_200015188469_100000765856 [0,0,1,0,0,0|1,0,0]=2 162 B15R2.2196 c1ccc(cc1)CCN[C@H]2CCOC2 2230a_100015188467_100000765856 [0,0,1,0,0,0|1,0,0]=2 163 B15R2.2196 c1ccc(cc1)CCN[C@H]2CCOC2 34a_100015188467_100000765856 [0,0,1,0,0,0|1,0,0]=2 164 B15R2.2196 c1ccc(cc1)CCOC2CCCC2 34a_100000210268_100000179811 [0,0,1,0,0,0|1,0,0]=2 165 B15R2.2196 c1ccc(cc1)CCOC2CCCC2 34a_100000210269_100000765856 [0,0,1,0,0,0|1,0,0]=2 166 B15R2.2196 c1ccc(cc1)CCOC2CCCC2 7a_100000210268_100000179811 [0,0,1,0,0,0|1,0,0]=2 167 B15R2.2196 c1ccc(cc1)CCOC2CCCC2 7a_100000210269_100000765856 [0,0,1,0,0,0|1,0,0]=2 168 B15R2.2196 c1ccc(cc1)CCOC2CCCO2 34a_100000085407_100000765856 [0,0,1,0,0,0|2,0,0]=3 169 B15R2.2196 c1ccc(cc1)CCOC2CCOC2 34a_100000210268_100000690089 [0,0,1,0,0,0|2,0,0]=3 170 B15R2.2196 c1ccc(cc1)CCOC2CCOC2 7a_100000210268_100000731011 [0,0,1,0,0,0|2,0,0]=3 171 B15R2.2196 c1ccc(cc1)CCOC2CCSC2 7a_100011232664_100000765856 [0,0,1,0,0,0|2,0,0]=3 172 B15R2.2196 c1ccc(cc1)CCO[C@H]2CCOC2 34a_100000717292_100000765856 [0,0,1,0,0,0|2,0,0]=3 173 B15R2.2196 c1ccc(cc1)CCSC2CCCC2 62a_100000765856_100000179811 [0,0,1,0,0,0|1,0,0]=2 174 B15R2.2196 c1ccc(cc1)CCSC2CCCC2 62a_100011217020_100011218657 [0,0,1,0,0,0|1,0,0]=2 175 B15R2.2196 c1ccc(cc1)CCSC2CCOC2 62a_100000765856_100000690089 [0,0,1,0,0,0|2,0,0]=3 176 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 207a_100000737975_100015611070 [0,0,1,0,0,0|2,0,0]=3 177 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 2230a_100000737975_100015291786 [0,0,1,0,0,0|2,0,0]=3 178 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 2230a_100015324214_100000740388 [0,0,1,0,0,0|2,0,0]=3 179 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 269862a_100015324214_100000746403 [0,0,1,0,0,0|2,0,0]=3 180 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 270004a_100000737975_100015611070 [0,0,1,0,0,0|2,0,0]=3 181 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 34a_100000737975_100015291786 [0,0,1,0,0,0|2,0,0]=3 182 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 34a_100015324214_100000740388 [0,0,1,0,0,0|2,0,0]=3 183 B15R2.2196 c1ccc(cc1)CNCC2CCCO2 2230a_100015324214_100000203698 [0,0,1,0,0,0|3,0,0]=4 184 B15R2.2196 c1ccc(cc1)CNCC2CCOC2 207a_100000737293_100015611070 [0,0,1,0,0,0|3,0,0]=4 185 B15R2.2196 c1ccc(cc1)CNCC2CCOC2 2230a_100000737293_100015291786 [0,0,1,0,0,0|3,0,0]=4 186 B15R2.2196 c1ccc(cc1)CNCC2CCOC2 2230a_100015324214_100000702531 [0,0,1,0,0,0|3,0,0]=4 187 B15R2.2196 c1ccc(cc1)CNCC2CCOC2 270004a_100000737293_100015611070 [0,0,1,0,0,0|3,0,0]=4 188 B15R2.2196 c1ccc(cc1)CNCC2CCOC2 34a_100000737293_100015291786 [0,0,1,0,0,0|3,0,0]=4 189 B15R2.2196 c1ccc(cc1)CNCC2CCOC2 34a_100015324214_100011261433 [0,0,1,0,0,0|3,0,0]=4 190 B15R2.2196 c1ccc(cc1)CNC[C@@H]2CCCO2 207a_100020590478_100015611070 [0,0,1,0,0,0|3,0,0]=4 191 B15R2.2196 c1ccc(cc1)CNC[C@@H]2CCCO2 2230a_100020590478_100015291786 [0,0,1,0,0,0|3,0,0]=4 192 B15R2.2196 c1ccc(cc1)CNC[C@@H]2CCCO2 270004a_100020590478_100015611070 [0,0,1,0,0,0|3,0,0]=4 193 B15R2.2196 c1ccc(cc1)CNC[C@@H]2CCCO2 34a_100020590478_100015291786 [0,0,1,0,0,0|3,0,0]=4 194 B15R2.2196 c1ccc(cc1)CNN=C2CCCC2 4a_100000007032_100000210133 [0,0,1,0,0,0|1,0,2]=4 195 B15R2.2196 c1ccc(cc1)COCC2CCCC2 34a_100000210790_100000740388 [0,0,1,0,0,0|2,0,0]=3 196 B15R2.2196 c1ccc(cc1)COCC2CCCC2 34a_100000742336_100015291786 [0,0,1,0,0,0|2,0,0]=3 197 B15R2.2196 c1ccc(cc1)COCC2CCCC2 7a_100000210790_100000740388 [0,0,1,0,0,0|2,0,0]=3 198 B15R2.2196 c1ccc(cc1)COCC2CCCC2 7a_100000742336_100000211182 [0,0,1,0,0,0|2,0,0]=3 199 B15R2.2196 c1ccc(cc1)COCC2CCCO2 34a_100000210270_100015291786 [0,0,1,0,0,0|3,0,0]=4 200 B15R2.2196 c1ccc(cc1)COCC2CCCO2 7a_100000210270_100000211182 [0,0,1,0,0,0|3,0,0]=4 201 B15R2.2196 c1ccc(cc1)COCC2CCCO2 7a_100000210790_100000203698 [0,0,1,0,0,0|3,0,0]=4 202 B15R2.2196 c1ccc(cc1)COCC2CCNC2 34a_100000748654_100015291786 [0,0,1,0,0,0|3,0,0]=4 203 B15R2.2196 c1ccc(cc1)COCC2CCOC2 34a_100000210790_100011261433 [0,0,1,0,0,0|3,0,0]=4 204 B15R2.2196 c1ccc(cc1)COCC2CCOC2 34a_100000740260_100015291786 [0,0,1,0,0,0|3,0,0]=4 205 B15R2.2196 c1ccc(cc1)COCC2CCOC2 7a_100000210790_100000702531 [0,0,1,0,0,0|3,0,0]=4 206 B15R2.2196 c1ccc(cc1)COCN2CCCC2 2230a_100000188435_100000763385 [0,0,1,0,0,0|3,0,0]=4 207 B15R2.2196 c1ccc(cc1)COC[C@H]2CCCN2 34a_100000745186_100015291786 [0,0,1,0,0,0|3,0,0]=4 208 B15R2.2196 c1ccc(cc1)CSCC2CCCC2 62a_100000211182_100000740388 [0,0,1,0,0,0|2,0,0]=3 209 B15R2.2196 c1ccc(cc1)CSCC2CCCC2 62a_100000740388_100015291786 [0,0,1,0,0,0|2,0,0]=3 210 B15R2.2196 c1ccc(cc1)CSCC2CCCO2 62a_100000203698_100015291786 [0,0,1,0,0,0|3,0,0]=4 211 B15R2.2196 c1ccc(cc1)CSCC2CCCO2 62a_100000211182_100000203698 [0,0,1,0,0,0|3,0,0]=4 212 B15R2.2196 c1ccc(cc1)CSCC2CCOC2 62a_100000211182_100000702531 [0,0,1,0,0,0|3,0,0]=4 213 B15R2.2196 c1ccc(cc1)CSCC2CCOC2 62a_100000702531_100015291786 [0,0,1,0,0,0|3,0,0]=4 214 B15R2.2196 c1ccc(cc1)CSCN2CCCC2 2230a_100000188435_200011217039 [0,0,1,0,0,0|3,0,0]=4 215 B15R2.2196 c1ccc(cc1)CSCN2CCCC2 269982a_100000188435_200011217039 [0,0,1,0,0,0|3,0,0]=4 216 B15R2.2196 c1ccc(cc1)NCCC2CCCC2 34a_100000106764_100000760354 [0,0,1,0,0,0|2,0,0]=3 217 B15R2.2196 c1ccc(cc1)OCCC2CCCC2 34a_100000210340_100000760354 [0,0,1,0,0,0|2,0,0]=3 218 B15R2.2196 c1ccc(cc1)OCCC2CCCC2 7a_100000210340_100000760354 [0,0,1,0,0,0|2,0,0]=3 219 B15R2.2196 c1ccc(cc1)OCCN2CCCC2 2230a_100000188435_100000184471 [0,0,1,0,0,0|3,0,0]=4 220 B15R2.2196 c1ccc(cc1)OCCN2CCCC2 269982a_100000188435_100000184471 [0,0,1,0,0,0|3,0,0]=4 221 B15R2.2196 c1ccc(cc1)OCCN2CCCC2 270004a_100000188435_100000758736 [0,0,1,0,0,0|3,0,0]=4 222 B15R2.2196 c1ccc(cc1)OCCN2CCCC2 7a_100000210340_100000004467 [0,0,1,0,0,0|3,0,0]=4 223 B15R2.2196 c1ccc(cc1)SCCC2CCCC2 62a_100000719477_100000760354 [0,0,1,0,0,0|2,0,0]=3 224 B15R2.2196 c1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000041952 [0,0,1,0,0,0|2,0,0]=3 225 B15R2.2196 c1ccc(cc1)SCCN2CCCC2 2230a_100000188435_100000246102 [0,0,1,0,0,0|3,0,0]=4 226 B15R2.2196 c1ccc(cc1)SCCN2CCCC2 269982a_100000188435_100000246102 [0,0,1,0,0,0|3,0,0]=4 227 B15R2.2196 c1ccc(cc1)SCCN2CCCC2 62a_100000700749_100000041952 [0,0,1,0,0,0|3,0,0]=4 228 B15R2.2196 c1ccc(cc1)SCCN2CCCC2 62a_100000719477_100000004467 [0,0,1,0,0,0|3,0,0]=4 229 B15R2.2196 c1ccc(cc1)SCNC2CCCC2 2230a_100000211070_100011218342 [0,0,1,0,0,0|1,0,0]=2 230 B15R2.2196 c1ccc(cc1)SCN[C@@H]2CCOC2 2230a_200015188469_100011218342 [0,0,1,0,0,0|2,0,0]=3 231 B15R2.2196 c1ccc(cc1)SCN[C@H]2CCOC2 2230a_100015188467_100011218342 [0,0,1,0,0,0|2,0,0]=3 232 B15R2.2196 c1ccc(cc1)SCSC2CCCC2 62a_100011217020_100011218342 [0,0,1,0,0,0|2,0,0]=3 233 B15R2.2196 c1ccc(cc1)SCSC2CCCC2 62a_100011218342_100000179811 [0,0,1,0,0,0|2,0,0]=3 234 B15R2.2196 c1ccc(cc1)SCSC2CCOC2 62a_100011218342_100000690089 [0,0,1,0,0,0|3,0,0]=4 235 B15R2.2196 c1ccc(nc1)CCNC2CCCC2 2230a_100000211070_100015183660 [0,0,1,0,0,0|1,0,0]=2 236 B15R2.2196 c1ccc(nc1)CCNC2CCCC2 270004a_100000211156_100000210133 [0,0,1,0,0,0|1,0,0]=2 237 B15R2.2196 c1ccc(nc1)CCNC2CCOC2 270004a_100000211156_100000752484 [0,0,1,0,0,0|2,0,0]=3 238 B15R2.2196 c1ccc(nc1)CCNC2CCSC2 270004a_100000211156_100000212027 [0,0,1,0,0,0|2,0,0]=3 239 B15R2.2196 c1ccc(nc1)CCN[C@@H]2CCOC2 2230a_200015188469_100015183660 [0,0,1,0,0,0|2,0,0]=3 240 B15R2.2196 c1ccc(nc1)CCN[C@H]2CCOC2 2230a_100015188467_100015183660 [0,0,1,0,0,0|2,0,0]=3 241 B15R2.2196 c1ccc(nc1)CCOC2CCCC2 34a_100000210271_100000179811 [0,0,1,0,0,0|2,0,0]=3 242 B15R2.2196 c1ccc(nc1)CCOC2CCCC2 7a_100000210269_100015183660 [0,0,1,0,0,0|2,0,0]=3 243 B15R2.2196 c1ccc(nc1)CCOC2CCOC2 34a_100000210271_100000690089 [0,0,1,0,0,0|3,0,0]=4 244 B15R2.2196 c1ccc(nc1)CCOC2CCSC2 7a_100011232664_100015183660 [0,0,1,0,0,0|3,0,0]=4 245 B15R2.2196 c1ccc(nc1)CCSC2CCCC2 62a_100011217020_100015183660 [0,0,1,0,0,0|2,0,0]=3 246 B15R2.2196 c1ccc(nc1)CCSC2CCCC2 62a_100015183660_100000179811 [0,0,1,0,0,0|2,0,0]=3 247 B15R2.2196 c1ccc(nc1)CCSC2CCOC2 62a_100015183660_100000690089 [0,0,1,0,0,0|3,0,0]=4 248 B15R2.2196 c1ccc(nc1)CNCC2CCCC2 207a_100000737975_100000209966 [0,0,1,0,0,0|3,0,0]=4 249 B15R2.2196 c1ccc(nc1)CNCC2CCCC2 2230a_100000737975_100000721315 [0,0,1,0,0,0|3,0,0]=4 250 B15R2.2196 c1ccc(nc1)CNCC2CCCC2 270004a_100000737975_100000209966 [0,0,1,0,0,0|3,0,0]=4 251 B15R2.2196 c1ccc(nc1)CNCC2CCCC2 34a_100000737975_100000721315 [0,0,1,0,0,0|3,0,0]=4 252 B15R2.2196 c1ccc(nc1)COCC2CCCC2 34a_100000742336_100000721315 [0,0,1,0,0,0|3,0,0]=4 253 B15R2.2196 c1ccc(nc1)COCC2CCCC2 7a_100000742336_100000721315 [0,0,1,0,0,0|3,0,0]=4 254 B15R2.2196 c1ccc(nc1)CSCC2CCCC2 62a_100000721315_100000740388 [0,0,1,0,0,0|3,0,0]=4 255 B15R2.2196 c1ccc(nc1)CSCC2CCCC2 62a_100000740388_100000721315 [0,0,1,0,0,0|3,0,0]=4 256 B15R2.2196 c1ccc(nc1)SCCC2CCCC2 62a_100000760354_100011216584 [0,0,1,0,0,0|3,0,0]=4 257 B15R2.2196 c1ccc(nc1)SCCC2CCCC2 62a_100011216584_100000760354 [0,0,1,0,0,0|3,0,0]=4 258 B15R2.2196 c1cnc(cn1)CCNC2CCCC2 270004a_100000723456_100000210133 [0,0,1,0,0,0|2,0,0]=3 259 B15R2.2196 c1cnc(cn1)CCNC2CCOC2 270004a_100000723456_100000752484 [0,0,1,0,0,0|3,0,0]=4 260 B15R2.2196 c1cnc(cn1)CCNC2CCSC2 270004a_100000723456_100000212027 [0,0,1,0,0,0|3,0,0]=4 261 B15R2.2196 c1cnc(cn1)CCOC2CCCC2 34a_100011349526_100000179811 [0,0,1,0,0,0|3,0,0]=4 262 B15R2.2196 c1cncc(c1)CCNC2CCCC2 2230a_100000211070_200011713674 [0,0,1,0,0,0|1,0,0]=2 263 B15R2.2196 c1cncc(c1)CCNC2CCCC2 2230a_100000736294_100000179811 [0,0,1,0,0,0|1,0,0]=2 264 B15R2.2196 c1cncc(c1)CCNC2CCCC2 270004a_100000736294_100000210133 [0,0,1,0,0,0|1,0,0]=2 265 B15R2.2196 c1cncc(c1)CCNC2CCOC2 2230a_100000736294_100000731011 [0,0,1,0,0,0|2,0,0]=3 266 B15R2.2196 c1cncc(c1)CCNC2CCOC2 270004a_100000736294_100000752484 [0,0,1,0,0,0|2,0,0]=3 267 B15R2.2196 c1cncc(c1)CCNC2CCSC2 270004a_100000736294_100000212027 [0,0,1,0,0,0|2,0,0]=3 268 B15R2.2196 c1cncc(c1)CCN[C@@H]2CCOC2 2230a_200015188469_200011713674 [0,0,1,0,0,0|2,0,0]=3 269 B15R2.2196 c1cncc(c1)CCN[C@H]2CCOC2 2230a_100015188467_200011713674 [0,0,1,0,0,0|2,0,0]=3 270 B15R2.2196 c1cncc(c1)CCOC2CCCC2 34a_100011217484_100000179811 [0,0,1,0,0,0|2,0,0]=3 271 B15R2.2196 c1cncc(c1)CCOC2CCCC2 7a_100000210269_200011713674 [0,0,1,0,0,0|2,0,0]=3 272 B15R2.2196 c1cncc(c1)CCOC2CCOC2 34a_100011217484_100000690089 [0,0,1,0,0,0|3,0,0]=4 273 B15R2.2196 c1cncc(c1)CCOC2CCSC2 7a_100011232664_200011713674 [0,0,1,0,0,0|3,0,0]=4 274 B15R2.2196 c1cncc(c1)CCSC2CCCC2 62a_100011217020_200011713674 [0,0,1,0,0,0|2,0,0]=3 275 B15R2.2196 c1cncc(c1)CCSC2CCCC2 62a_200011713674_100000179811 [0,0,1,0,0,0|2,0,0]=3 276 B15R2.2196 c1cncc(c1)CCSC2CCOC2 62a_200011713674_100000690089 [0,0,1,0,0,0|3,0,0]=4 277 B15R2.2196 c1cncc(c1)CNCC2CCCC2 207a_100000737975_100000209961 [0,0,1,0,0,0|3,0,0]=4 278 B15R2.2196 c1cncc(c1)CNCC2CCCC2 2230a_100000737975_100000741622 [0,0,1,0,0,0|3,0,0]=4 279 B15R2.2196 c1cncc(c1)CNCC2CCCC2 269862a_100000210453_100000746403 [0,0,1,0,0,0|3,0,0]=4 280 B15R2.2196 c1cncc(c1)CNCC2CCCC2 270004a_100000737975_100000209961 [0,0,1,0,0,0|3,0,0]=4 281 B15R2.2196 c1cncc(c1)CNCC2CCCC2 34a_100000737975_100000733263 [0,0,1,0,0,0|3,0,0]=4 282 B15R2.2196 c1cncc(c1)COCC2CCCC2 34a_100000742336_100000733263 [0,0,1,0,0,0|3,0,0]=4 283 B15R2.2196 c1cncc(c1)COCC2CCCC2 7a_100000742336_100000741622 [0,0,1,0,0,0|3,0,0]=4 284 B15R2.2196 c1cncc(c1)CSCC2CCCC2 62a_100000740388_100000741622 [0,0,1,0,0,0|3,0,0]=4 285 B15R2.2196 c1cncc(c1)CSCC2CCCC2 62a_100000741622_100000740388 [0,0,1,0,0,0|3,0,0]=4 286 B15R2.2196 c1cncc(c1)OCCC2CCCC2 34a_100000210849_100000760354 [0,0,1,0,0,0|3,0,0]=4 287 B15R2.2196 c1cncc(c1)OCCC2CCCC2 7a_100000210849_100000760354 [0,0,1,0,0,0|3,0,0]=4 288 B15R2.2196 c1cncc(c1)SCCC2CCCC2 62a_100000210063_100000760354 [0,0,1,0,0,0|3,0,0]=4 289 B15R2.2196 c1cncc(c1)SCCC2CCCC2 62a_100000760354_100000210063 [0,0,1,0,0,0|3,0,0]=4 290 B15R2.2196 c1ncc(cn1)CCOC2CCCC2 34a_100011709255_100000179811 [0,0,1,0,0,0|3,0,0]=4 291 B14R2.8 CCN1CCC(C1)c2ccccc2 2230a_100000747531_100000210202 [1,0,1,0,0,0|2,0,0]=4 292 B14R2.8 CCN1CCC(C1)c2ccccc2 269982a_100000747531_100000204670 [1,0,1,0,0,0|2,0,0]=4 293 B14R2.8 CCN1CCC(C1)c2ccccc2 34a_100000747531_100000210202 [1,0,1,0,0,0|2,0,0]=4 294 B14R2.8 CNC1CCC(C1)c2ccccc2 270004a_106832991635_100000750937 [1,0,1,0,0,0|2,0,0]=4 295 B14R2.14 CCN1CCCC1c2ccccc2 2230a_100000243309_100000210202 [1,0,1,0,0,0|2,0,0]=4 296 B14R2.14 CCN1CCCC1c2ccccc2 269982a_100000243309_100000204670 [1,0,1,0,0,0|2,0,0]=4 297 B14R2.14 CCN1CCCC1c2ccccc2 34a_100000243309_100000210202 [1,0,1,0,0,0|2,0,0]=4 298 B14R2.14 CN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_200000210301 [1,0,1,0,0,0|2,0,0]=4 299 B14R2.14 CN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_200000210301 [1,0,1,0,0,0|2,0,0]=4 300 B14R2.14 COC1COCC1c2ccccc2 34a_100010739164_200000210301 [1,0,1,0,0,0|2,0,0]=4 301 B14R2.14 COC1COCC1c2ccccc2 7a_100010739164_200000210301 [1,0,1,0,0,0|2,0,0]=4 302 B14R2.14 [13CH3]N[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_200025704644 [1,0,1,0,0,0|2,0,0]=4 303 B14R2.14 [13CH3]N[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_200025704644 [1,0,1,0,0,0|2,0,0]=4 304 B14R2.14 [13CH3]OC1COCC1c2ccccc2 34a_100010739164_200025704644 [1,0,1,0,0,0|2,0,0]=4 305 B14R2.14 [13CH3]OC1COCC1c2ccccc2 7a_100010739164_200025704644 [1,0,1,0,0,0|2,0,0]=4 306 B14R2.30 CC1SCCN1Cc2ccccc2 2230a_200011216479_100015291786 [1,0,1,0,0,0|2,0,0]=4 307 B14R2.30 CC1SCCN1Cc2ccccc2 269982a_200011216479_100000211182 [1,0,1,0,0,0|2,0,0]=4 308 B14R2.30 CC1SCCN1Cc2ccccc2 270004a_200011216479_100015611070 [1,0,1,0,0,0|2,0,0]=4 309 B14R2.30 CC1SCCN1Cc2ccccc2 34a_200011216479_100015291786 [1,0,1,0,0,0|2,0,0]=4 310 B14R2.30 CN1CCCC1Cc2ccccc2 2230a_100159249835_200000210301 [1,0,1,0,0,0|1,0,0]=3 311 B14R2.30 CN1CCCC1Cc2ccccc2 269982a_100159249835_200000210301 [1,0,1,0,0,0|1,0,0]=3 312 B14R2.30 CN1CCCC1Cc2ccccc2 34a_100159249835_200000210301 [1,0,1,0,0,0|1,0,0]=3 313 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 2230a_100015189458_100015291786 [1,0,1,0,0,0|1,0,0]=3 314 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 269982a_100015189458_100000211182 [1,0,1,0,0,0|1,0,0]=3 315 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 270004a_100015189458_100015611070 [1,0,1,0,0,0|1,0,0]=3 316 B14R2.30 C[C@@H]1CCCN1Cc2ccccc2 34a_100015189458_100015291786 [1,0,1,0,0,0|1,0,0]=3 317 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 2230a_100015189458_100000721315 [1,0,1,0,0,0|2,0,0]=4 318 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 269982a_100015189458_100000721315 [1,0,1,0,0,0|2,0,0]=4 319 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 270004a_100015189458_100000209966 [1,0,1,0,0,0|2,0,0]=4 320 B14R2.30 C[C@@H]1CCCN1Cc2ccccn2 34a_100015189458_100000721315 [1,0,1,0,0,0|2,0,0]=4 321 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 2230a_100015189458_100000741622 [1,0,1,0,0,0|2,0,0]=4 322 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 269982a_100015189458_100000733263 [1,0,1,0,0,0|2,0,0]=4 323 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 270004a_100015189458_100000209961 [1,0,1,0,0,0|2,0,0]=4 324 B14R2.30 C[C@@H]1CCCN1Cc2cccnc2 34a_100015189458_100000733263 [1,0,1,0,0,0|2,0,0]=4 325 B14R2.30 C[C@@H]1CCCN1Cc2ccncc2 2230a_100015189458_100015193705 [1,0,1,0,0,0|2,0,0]=4 326 B14R2.30 C[C@@H]1CCCN1Cc2ccncc2 269982a_100015189458_100015193705 [1,0,1,0,0,0|2,0,0]=4 327 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 2230a_100020605311_100015291786 [1,0,1,0,0,0|1,0,0]=3 328 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 269982a_100020605311_100000211182 [1,0,1,0,0,0|1,0,0]=3 329 B14R2.30 C[C@H]1CCCN1Cc2ccccc2 270004a_100020605311_100015611070 [1,0,1,0,0,0|1,0,0]=3 330 B14R2.30 C[C@H]1CCCN1Cc2ccccn2 2230a_100020605311_100000721315 [1,0,1,0,0,0|2,0,0]=4 331 B14R2.30 C[C@H]1CCCN1Cc2ccccn2 269982a_100020605311_100000721315 [1,0,1,0,0,0|2,0,0]=4 332 B14R2.30 C[C@H]1CCCN1Cc2ccccn2 270004a_100020605311_100000209966 [1,0,1,0,0,0|2,0,0]=4 333 B14R2.30 C[C@H]1CCCN1Cc2cccnc2 2230a_100020605311_100000741622 [1,0,1,0,0,0|2,0,0]=4 334 B14R2.30 C[C@H]1CCCN1Cc2cccnc2 269982a_100020605311_100000733263 [1,0,1,0,0,0|2,0,0]=4 335 B14R2.30 C[C@H]1CCCN1Cc2cccnc2 270004a_100020605311_100000209961 [1,0,1,0,0,0|2,0,0]=4 336 B14R2.30 C[C@H]1CCCN1Cc2ccncc2 2230a_100020605311_100015193705 [1,0,1,0,0,0|2,0,0]=4 337 B14R2.30 C[C@H]1CCCN1Cc2ccncc2 269982a_100020605311_100015193705 [1,0,1,0,0,0|2,0,0]=4 338 B14R2.30 O[C@@H]1CCC[C@H]1Sc2ccccc2 62a_100000719477_200016002552 [1,0,1,0,0,0|2,0,0]=4 339 B14R2.30 O[C@@H]1CCC[C@H]1Sc2ccccc2 62a_200016002552_100000041952 [1,0,1,0,0,0|2,0,0]=4 340 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 2230a_100159249835_200025704644 [1,0,1,0,0,0|1,0,0]=3 341 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 269982a_100159249835_200025704644 [1,0,1,0,0,0|1,0,0]=3 342 B14R2.30 [13CH3]N1CCCC1Cc2ccccc2 34a_100159249835_200025704644 [1,0,1,0,0,0|1,0,0]=3 343 B14R2.114 CC(c1ccccc1)N2CCCC2 2230a_100000188435_100000230085 [1,0,1,0,0,0|1,0,0]=3 344 B14R2.114 CC(c1ccccc1)N2CCCC2 269982a_100000188435_100000230085 [1,0,1,0,0,0|1,0,0]=3 345 B14R2.114 CC(c1ccccc1)N2CCSC2 2230a_100011215254_100000230085 [1,0,1,0,0,0|2,0,0]=4 346 B14R2.114 CC(c1ccccc1)N2CCSC2 269982a_100011215254_100000230085 [1,0,1,0,0,0|2,0,0]=4 347 B14R2.114 CN(c1ccccc1)C2CCCC2 2230a_100000210012_100000179811 [1,0,1,0,0,0|1,0,0]=3 348 B14R2.114 CN(c1ccccc1)C2CCCC2 269982a_100000210012_100000179811 [1,0,1,0,0,0|1,0,0]=3 349 B14R2.114 CN(c1ccccc1)C2CCCC2 34a_100000210012_100000179811 [1,0,1,0,0,0|1,0,0]=3 350 B14R2.114 CN(c1ccccc1)C2CCOC2 2230a_100000210012_100000731011 [1,0,1,0,0,0|2,0,0]=4 351 B14R2.114 CN(c1ccccc1)C2CCOC2 269982a_100000210012_100000731011 [1,0,1,0,0,0|2,0,0]=4 352 B14R2.114 CN(c1ccccc1)C2CCOC2 34a_100000210012_100000690089 [1,0,1,0,0,0|2,0,0]=4 353 B14R2.114 O=C(c1ccccc1)C2CCCC2 1458a_100000185807_100000179811 [1,0,1,0,0,0|1,0,1]=4 354 B16R2.63 CCCN1CCC(C1)c2ccc(cc2)Cl 2230a_100000754569_100000210303 [0,1,1,0,0,0|2,0,0]=4 355 B16R2.63 CCCN1CCC(C1)c2ccc(cc2)Cl 269982a_100000754569_100000210303 [0,1,1,0,0,0|2,0,0]=4 356 B16R2.63 CCCN1CCC(C1)c2ccc(cc2)Cl 34a_100000754569_100000210303 [0,1,1,0,0,0|2,0,0]=4 357 B16R2.63 CCCN1CCC(C1)c2ccc(cc2)F 2230a_200000685600_100000210303 [0,1,1,0,0,0|2,0,0]=4 358 B16R2.63 CCCN1CCC(C1)c2ccc(cc2)F 269982a_200000685600_100000210303 [0,1,1,0,0,0|2,0,0]=4 359 B16R2.63 CCCN1CCC(C1)c2ccc(cc2)F 34a_200000685600_100000210303 [0,1,1,0,0,0|2,0,0]=4 360 B16R2.141 CCC(C)N1CCC(C1)c2ccccc2 2230a_100000747531_100000758301 [0,1,1,0,0,0|2,0,0]=4 361 B16R2.141 CCC(C)N1CCC(C1)c2ccccc2 269982a_100000747531_100000758301 [0,1,1,0,0,0|2,0,0]=4 362 B16R2.141 CCC(C)N1CCC(C1)c2ccccc2 34a_100000747531_100011215416 [0,1,1,0,0,0|2,0,0]=4 363 B16R2.150 CCCCN1CCC(C1)c2ccccc2 2230a_100000747531_100000210211 [0,1,1,0,0,0|2,0,0]=4 364 B16R2.150 CCCCN1CCC(C1)c2ccccc2 269982a_100000747531_100000210211 [0,1,1,0,0,0|2,0,0]=4 365 B16R2.150 CCCCN1CCC(C1)c2ccccc2 34a_100000747531_100000210210 [0,1,1,0,0,0|2,0,0]=4 366 B16R2.150 CCCNC1CCC(C1)c2ccccc2 270004a_100020643023_100000750937 [0,1,1,0,0,0|1,0,0]=3 367 B16R2.150 CCOCC1CCN(C1)c2ccccc2 34a_100000758375_100000210202 [0,1,1,0,0,0|2,0,0]=4 368 B16R2.150 CCOCC1CCN(C1)c2ccccc2 7a_100000758375_100000210202 [0,1,1,0,0,0|2,0,0]=4 369 B16R2.150 CCOCN1CCC(C1)c2ccccc2 269982a_100000747531_100000739092 [0,1,1,0,0,0|2,0,0]=4 370 B16R2.150 COCCN1CCC(C1)c2ccccc2 2230a_100000747531_100011201679 [0,1,1,0,0,0|2,0,0]=4 371 B16R2.150 COCCN1CCC(C1)c2ccccc2 269982a_100000747531_100000233755 [0,1,1,0,0,0|2,0,0]=4 372 B16R2.150 COCCN1CCC(C1)c2ccccc2 34a_100000747531_100011201679 [0,1,1,0,0,0|2,0,0]=4 373 B16R2.150 CSCCN1CCC(C1)c2ccccc2 2230a_100000747531_100000751147 [0,1,1,0,0,0|2,0,0]=4 374 B16R2.150 CSCCN1CCC(C1)c2ccccc2 269982a_100000747531_100000212216 [0,1,1,0,0,0|2,0,0]=4 375 B16R2.150 CSCCN1CCC(C1)c2ccccc2 34a_100000747531_100000212216 [0,1,1,0,0,0|2,0,0]=4 376 B16R2.150 FCCCN1CCC(C1)c2ccccc2 2230a_100000747531_100011934791 [0,1,1,0,0,0|2,0,0]=4 377 B16R2.150 FCCCN1CCC(C1)c2ccccc2 269982a_100000747531_100011934791 [0,1,1,0,0,0|2,0,0]=4 378 B16R2.150 FCCCN1CCC(C1)c2ccccc2 34a_100000747531_100011934791 [0,1,1,0,0,0|2,0,0]=4 379 B16R2.150 OCCCN1CCC(C1)c2ccccc2 2230a_100000747531_100000230001 [0,1,1,0,0,0|2,0,0]=4 380 B16R2.150 OCCCN1CCC(C1)c2ccccc2 269982a_100000747531_100011215043 [0,1,1,0,0,0|2,0,0]=4 381 B16R2.150 OCCCN1CCC(C1)c2ccccc2 34a_100000747531_100000230001 [0,1,1,0,0,0|2,0,0]=4 382 B16R2.150 OCCNC1CCC(C1)c2ccccc2 270004a_100000210304_100000750937 [0,1,1,0,0,0|2,0,0]=4 383 B16R2.157 CC(C)CN1CCC(C1)c2ccccc2 2230a_100000747531_100000210760 [0,1,1,0,0,0|2,0,0]=4 384 B16R2.157 CC(C)CN1CCC(C1)c2ccccc2 269982a_100000747531_100000210624 [0,1,1,0,0,0|2,0,0]=4 385 B16R2.157 CC(C)CN1CCC(C1)c2ccccc2 270004a_100000747531_100000210432 [0,1,1,0,0,0|2,0,0]=4 386 B16R2.157 CC(C)CN1CCC(C1)c2ccccc2 34a_100000747531_100000210624 [0,1,1,0,0,0|2,0,0]=4 387 B16R2.157 CC(O)CN1CCC(C1)c2ccccc2 2230a_100000747531_100011218427 [0,1,1,0,0,0|2,0,0]=4 388 B16R2.157 CC(O)CN1CCC(C1)c2ccccc2 269982a_100000747531_100011218427 [0,1,1,0,0,0|2,0,0]=4 389 B16R2.157 CC(O)CN1CCC(C1)c2ccccc2 34a_100000747531_100011218427 [0,1,1,0,0,0|2,0,0]=4 390 B16R2.157 C[C@@H](O)CN1CCC(C1)c2ccccc2 2230a_100000747531_100009817552 [0,1,1,0,0,0|2,0,0]=4 391 B16R2.157 C[C@@H](O)CN1CCC(C1)c2ccccc2 269982a_100000747531_100009817552 [0,1,1,0,0,0|2,0,0]=4 392 B16R2.157 C[C@@H](O)CN1CCC(C1)c2ccccc2 34a_100000747531_100009817552 [0,1,1,0,0,0|2,0,0]=4 393 B16R2.546 CCCN1CCC(C1)c2ccccc2Br 2230a_100010170462_100000210303 [0,1,1,0,0,0|2,0,0]=4 394 B16R2.546 CCCN1CCC(C1)c2ccccc2Br 269982a_100010170462_100000210303 [0,1,1,0,0,0|2,0,0]=4 395 B16R2.546 CCCN1CCC(C1)c2ccccc2Br 34a_100010170462_100000210303 [0,1,1,0,0,0|2,0,0]=4 396 B16R2.546 CCCN1CCC(C1)c2ccccc2Cl 2230a_100015183920_100000210303 [0,1,1,0,0,0|2,0,0]=4 397 B16R2.546 CCCN1CCC(C1)c2ccccc2Cl 269982a_100015183920_100000210303 [0,1,1,0,0,0|2,0,0]=4 398 B16R2.546 CCCN1CCC(C1)c2ccccc2Cl 34a_100015183920_100000210303 [0,1,1,0,0,0|2,0,0]=4 399 B16R2.546 CCCN1CCC(C1)c2ccccc2F 2230a_100000704893_100000210303 [0,1,1,0,0,0|2,0,0]=4 400 B16R2.546 CCCN1CCC(C1)c2ccccc2F 269982a_100000704893_100000210303 [0,1,1,0,0,0|2,0,0]=4 401 B16R2.546 CCCN1CCC(C1)c2ccccc2F 34a_100000704893_100000210303 [0,1,1,0,0,0|2,0,0]=4 402 B16R2.99 CCCN1CCCC1c2ccc(cc2)Br 2230a_100000766735_100000210303 [0,1,1,0,0,0|2,0,0]=4 403 B16R2.99 CCCN1CCCC1c2ccc(cc2)Br 269982a_100000766735_100000210303 [0,1,1,0,0,0|2,0,0]=4 404 B16R2.99 CCCN1CCCC1c2ccc(cc2)Br 34a_100000766735_100000210303 [0,1,1,0,0,0|2,0,0]=4 405 B16R2.99 CCCN1CCCC1c2ccc(cc2)C 2230a_100000736514_100000210303 [0,1,1,0,0,0|2,0,0]=4 406 B16R2.99 CCCN1CCCC1c2ccc(cc2)C 269982a_100000736514_100000210303 [0,1,1,0,0,0|2,0,0]=4 407 B16R2.99 CCCN1CCCC1c2ccc(cc2)C 34a_100000736514_100000210303 [0,1,1,0,0,0|2,0,0]=4 408 B16R2.99 CCCN1CCCC1c2ccc(cc2)Cl 2230a_100000736974_100000210303 [0,1,1,0,0,0|2,0,0]=4 409 B16R2.99 CCCN1CCCC1c2ccc(cc2)Cl 269982a_100000736974_100000210303 [0,1,1,0,0,0|2,0,0]=4 410 B16R2.99 CCCN1CCCC1c2ccc(cc2)Cl 34a_100000736974_100000210303 [0,1,1,0,0,0|2,0,0]=4 411 B16R2.99 CCCN1CCCC1c2ccc(cc2)F 2230a_100000243150_100000210303 [0,1,1,0,0,0|2,0,0]=4 412 B16R2.99 CCCN1CCCC1c2ccc(cc2)F 269982a_100000243150_100000210303 [0,1,1,0,0,0|2,0,0]=4 413 B16R2.99 CCCN1CCCC1c2ccc(cc2)F 34a_100000243150_100000210303 [0,1,1,0,0,0|2,0,0]=4 414 B16R2.148 CCC(C)N1CCCC1c2ccccc2 2230a_100000243309_100000758301 [0,1,1,0,0,0|2,0,0]=4 415 B16R2.148 CCC(C)N1CCCC1c2ccccc2 269982a_100000243309_100000758301 [0,1,1,0,0,0|2,0,0]=4 416 B16R2.148 CCC(C)N1CCCC1c2ccccc2 34a_100000243309_100011215416 [0,1,1,0,0,0|2,0,0]=4 417 B16R2.156 CCCCN1CCCC1c2ccccc2 2230a_100000243309_100000210211 [0,1,1,0,0,0|2,0,0]=4 418 B16R2.156 CCCCN1CCCC1c2ccccc2 269982a_100000243309_100000210211 [0,1,1,0,0,0|2,0,0]=4 419 B16R2.156 CCCCN1CCCC1c2ccccc2 34a_100000243309_100000210210 [0,1,1,0,0,0|2,0,0]=4 420 B16R2.156 CCCN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100000210303 [0,1,1,0,0,0|1,0,0]=3 421 B16R2.156 CCCN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100000210303 [0,1,1,0,0,0|1,0,0]=3 422 B16R2.156 CCCOC1COCC1c2ccccc2 34a_100010739164_100000210303 [0,1,1,0,0,0|1,0,0]=3 423 B16R2.156 CCCOC1COCC1c2ccccc2 7a_100010739164_100000210303 [0,1,1,0,0,0|1,0,0]=3 424 B16R2.156 CCOCN1CCCC1c2ccccc2 269982a_100000243309_100000739092 [0,1,1,0,0,0|2,0,0]=4 425 B16R2.156 COCCN1CCCC1c2ccccc2 2230a_100000243309_100011201679 [0,1,1,0,0,0|2,0,0]=4 426 B16R2.156 COCCN1CCCC1c2ccccc2 269982a_100000243309_100000233755 [0,1,1,0,0,0|2,0,0]=4 427 B16R2.156 COCCN1CCCC1c2ccccc2 34a_100000243309_100011201679 [0,1,1,0,0,0|2,0,0]=4 428 B16R2.156 COCN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100000766300 [0,1,1,0,0,0|2,0,0]=4 429 B16R2.156 CSCCN1CCCC1c2ccccc2 2230a_100000243309_100000751147 [0,1,1,0,0,0|2,0,0]=4 430 B16R2.156 CSCCN1CCCC1c2ccccc2 269982a_100000243309_100000212216 [0,1,1,0,0,0|2,0,0]=4 431 B16R2.156 CSCCN1CCCC1c2ccccc2 34a_100000243309_100000212216 [0,1,1,0,0,0|2,0,0]=4 432 B16R2.156 CSCN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100011218213 [0,1,1,0,0,0|2,0,0]=4 433 B16R2.156 CSCN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100011218213 [0,1,1,0,0,0|2,0,0]=4 434 B16R2.156 CSCOC1COCC1c2ccccc2 34a_100010739164_100011218213 [0,1,1,0,0,0|2,0,0]=4 435 B16R2.156 FCCCN1CCCC1c2ccccc2 2230a_100000243309_100011934791 [0,1,1,0,0,0|2,0,0]=4 436 B16R2.156 FCCCN1CCCC1c2ccccc2 269982a_100000243309_100011934791 [0,1,1,0,0,0|2,0,0]=4 437 B16R2.156 FCCCN1CCCC1c2ccccc2 34a_100000243309_100011934791 [0,1,1,0,0,0|2,0,0]=4 438 B16R2.156 FCCN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100011217306 [0,1,1,0,0,0|2,0,0]=4 439 B16R2.156 FCCN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100011217306 [0,1,1,0,0,0|2,0,0]=4 440 B16R2.156 FCCOC1COCC1c2ccccc2 34a_100010739164_100011217306 [0,1,1,0,0,0|2,0,0]=4 441 B16R2.156 FCCOC1COCC1c2ccccc2 7a_100010739164_100011217306 [0,1,1,0,0,0|2,0,0]=4 442 B16R2.156 OCCCN1CCCC1c2ccccc2 2230a_100000243309_100000230001 [0,1,1,0,0,0|2,0,0]=4 443 B16R2.156 OCCCN1CCCC1c2ccccc2 269982a_100000243309_100011215043 [0,1,1,0,0,0|2,0,0]=4 444 B16R2.156 OCCCN1CCCC1c2ccccc2 34a_100000243309_100000230001 [0,1,1,0,0,0|2,0,0]=4 445 B16R2.156 OCCN[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100000211926 [0,1,1,0,0,0|2,0,0]=4 446 B16R2.156 OCCN[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100000211926 [0,1,1,0,0,0|2,0,0]=4 447 B16R2.156 OCCOC1COCC1c2ccccc2 34a_100010739164_100000211926 [0,1,1,0,0,0|2,0,0]=4 448 B16R2.156 OCCOC1COCC1c2ccccc2 7a_100010739164_100000211926 [0,1,1,0,0,0|2,0,0]=4 449 B16R2.161 CC(C)CN1CCCC1c2ccccc2 2230a_100000243309_100000210760 [0,1,1,0,0,0|2,0,0]=4 450 B16R2.161 CC(C)CN1CCCC1c2ccccc2 269982a_100000243309_100000210624 [0,1,1,0,0,0|2,0,0]=4 451 B16R2.161 CC(C)CN1CCCC1c2ccccc2 270004a_100000243309_100000210432 [0,1,1,0,0,0|2,0,0]=4 452 B16R2.161 CC(C)CN1CCCC1c2ccccc2 34a_100000243309_100000210624 [0,1,1,0,0,0|2,0,0]=4 453 B16R2.161 CC(C)N[C@@H]1CCC[C@@H]1c2ccccc2 2230a_100009885948_100000210206 [0,1,1,0,0,0|2,0,0]=4 454 B16R2.161 CC(C)N[C@@H]1CCC[C@@H]1c2ccccc2 34a_100009885948_100000210206 [0,1,1,0,0,0|2,0,0]=4 455 B16R2.161 CC(C)OC1COCC1c2ccccc2 34a_100010739164_100000210206 [0,1,1,0,0,0|2,0,0]=4 456 B16R2.161 CC(C)OC1COCC1c2ccccc2 7a_100010739164_100000210206 [0,1,1,0,0,0|2,0,0]=4 457 B16R2.161 CC(O)CN1CCCC1c2ccccc2 2230a_100000243309_100011218427 [0,1,1,0,0,0|2,0,0]=4 458 B16R2.161 CC(O)CN1CCCC1c2ccccc2 269982a_100000243309_100011218427 [0,1,1,0,0,0|2,0,0]=4 459 B16R2.161 CC(O)CN1CCCC1c2ccccc2 34a_100000243309_100011218427 [0,1,1,0,0,0|2,0,0]=4 460 B16R2.161 C[C@@H](O)CN1CCCC1c2ccccc2 2230a_100000243309_100009817552 [0,1,1,0,0,0|2,0,0]=4 461 B16R2.161 C[C@@H](O)CN1CCCC1c2ccccc2 269982a_100000243309_100009817552 [0,1,1,0,0,0|2,0,0]=4 462 B16R2.161 C[C@@H](O)CN1CCCC1c2ccccc2 34a_100000243309_100009817552 [0,1,1,0,0,0|2,0,0]=4 463 B16R2.664 CCCN1CCCC1c2ccccc2Br 2230a_100000686366_100000210303 [0,1,1,0,0,0|2,0,0]=4 464 B16R2.664 CCCN1CCCC1c2ccccc2Br 269982a_100000686366_100000210303 [0,1,1,0,0,0|2,0,0]=4 465 B16R2.664 CCCN1CCCC1c2ccccc2Br 34a_100000686366_100000210303 [0,1,1,0,0,0|2,0,0]=4 466 B16R2.664 CCCN1CCCC1c2ccccc2C 2230a_100000742541_100000210303 [0,1,1,0,0,0|2,0,0]=4 467 B16R2.664 CCCN1CCCC1c2ccccc2C 269982a_100000742541_100000210303 [0,1,1,0,0,0|2,0,0]=4 468 B16R2.664 CCCN1CCCC1c2ccccc2C 34a_100000742541_100000210303 [0,1,1,0,0,0|2,0,0]=4 469 B16R2.664 CCCN1CCCC1c2ccccc2Cl 2230a_100000742539_100000210303 [0,1,1,0,0,0|2,0,0]=4 470 B16R2.664 CCCN1CCCC1c2ccccc2Cl 269982a_100000742539_100000210303 [0,1,1,0,0,0|2,0,0]=4 471 B16R2.664 CCCN1CCCC1c2ccccc2Cl 34a_100000742539_100000210303 [0,1,1,0,0,0|2,0,0]=4 472 B16R2.664 CCCN1CCCC1c2ccccc2F 2230a_100011206064_100000210303 [0,1,1,0,0,0|2,0,0]=4 473 B16R2.664 CCCN1CCCC1c2ccccc2F 269982a_100011206064_100000210303 [0,1,1,0,0,0|2,0,0]=4 474 B16R2.664 CCCN1CCCC1c2ccccc2F 34a_100011206064_100000210303 [0,1,1,0,0,0|2,0,0]=4 475 B16R2.2813 CCCN1CCCC1c2cccc(c2)Br 2230a_100015187783_100000210303 [0,1,1,0,0,0|2,0,0]=4 476 B16R2.2813 CCCN1CCCC1c2cccc(c2)Br 269982a_100015187783_100000210303 [0,1,1,0,0,0|2,0,0]=4 477 B16R2.2813 CCCN1CCCC1c2cccc(c2)Br 34a_100015187783_100000210303 [0,1,1,0,0,0|2,0,0]=4 478 B16R2.2813 CCCN1CCCC1c2cccc(c2)C 2230a_100000741861_100000210303 [0,1,1,0,0,0|2,0,0]=4 479 B16R2.2813 CCCN1CCCC1c2cccc(c2)C 269982a_100000741861_100000210303 [0,1,1,0,0,0|2,0,0]=4 480 B16R2.2813 CCCN1CCCC1c2cccc(c2)C 34a_100000741861_100000210303 [0,1,1,0,0,0|2,0,0]=4 481 B16R2.2813 CCCN1CCCC1c2cccc(c2)Cl 2230a_100000741648_100000210303 [0,1,1,0,0,0|2,0,0]=4 482 B16R2.2813 CCCN1CCCC1c2cccc(c2)Cl 269982a_100000741648_100000210303 [0,1,1,0,0,0|2,0,0]=4 483 B16R2.2813 CCCN1CCCC1c2cccc(c2)Cl 34a_100000741648_100000210303 [0,1,1,0,0,0|2,0,0]=4 484 B16R2.2813 CCCN1CCCC1c2cccc(c2)F 2230a_100000742875_100000210303 [0,1,1,0,0,0|2,0,0]=4 485 B16R2.2813 CCCN1CCCC1c2cccc(c2)F 269982a_100000742875_100000210303 [0,1,1,0,0,0|2,0,0]=4 486 B16R2.2813 CCCN1CCCC1c2cccc(c2)F 34a_100000742875_100000210303 [0,1,1,0,0,0|2,0,0]=4 487 B16R2.59 CCCN1CCCC1Cc2ccccc2 2230a_100159249835_100000210303 [0,1,1,0,0,0|2,0,0]=4 488 B16R2.59 CCCN1CCCC1Cc2ccccc2 269982a_100159249835_100000210303 [0,1,1,0,0,0|2,0,0]=4 489 B16R2.59 CCCN1CCCC1Cc2ccccc2 34a_100159249835_100000210303 [0,1,1,0,0,0|2,0,0]=4 490 B16R2.59 CCNC1CCCC1Cc2ccccc2 269862a_100015525214_200000757594 [0,1,1,0,0,0|0,0,0]=2 491 B16R2.59 CCNC1CCCC1Cc2ccccc2 270004a_100015525214_200000757594 [0,1,1,0,0,0|0,0,0]=2 492 B16R2.59 CNC[C@H]1CCCN1Cc2ccccc2 7a_106832991635_100015185826 [0,1,1,0,0,0|1,0,0]=3 493 B16R2.59 COCN1CCCC1Cc2ccccc2 2230a_100159249835_100000766300 [0,1,1,0,0,0|2,0,0]=4 494 B16R2.59 COCN1CCCC1Cc2ccccc2 269982a_100159249835_100000766300 [0,1,1,0,0,0|2,0,0]=4 495 B16R2.59 COC[C@@H]1CCCN1Cc2ccccc2 2230a_100020646714_100015291786 [0,1,1,0,0,0|2,0,0]=4 496 B16R2.59 COC[C@@H]1CCCN1Cc2ccccc2 269982a_100020646714_100000211182 [0,1,1,0,0,0|2,0,0]=4 497 B16R2.59 COC[C@@H]1CCCN1Cc2ccccc2 270004a_100020646714_100015611070 [0,1,1,0,0,0|2,0,0]=4 498 B16R2.59 COC[C@@H]1CCCN1Cc2ccccc2 34a_100011827623_200000210301 [0,1,1,0,0,0|2,0,0]=4 499 B16R2.59 COC[C@@H]1CCCN1Cc2ccccc2 34a_100020646714_100015291786 [0,1,1,0,0,0|2,0,0]=4 500 B16R2.59 COC[C@@H]1CCCN1Cc2ccccc2 7a_100011827623_200000210301 [0,1,1,0,0,0|2,0,0]=4 501 B16R2.59 CSCN1CCCC1Cc2ccccc2 2230a_100159249835_100011218213 [0,1,1,0,0,0|2,0,0]=4 502 B16R2.59 CSCN1CCCC1Cc2ccccc2 269982a_100159249835_100011218213 [0,1,1,0,0,0|2,0,0]=4 503 B16R2.59 CSCN1CCCC1Cc2ccccc2 34a_100159249835_100011218213 [0,1,1,0,0,0|2,0,0]=4 504 B16R2.59 CSC[C@H]1CCCN1Cc2ccccc2 62a_100015185826_200000210301 [0,1,1,0,0,0|2,0,0]=4 505 B16R2.59 CSC[C@H]1CCCN1Cc2ccccc2 62a_200000210301_100015185826 [0,1,1,0,0,0|2,0,0]=4 506 B16R2.59 FCCN1CCCC1Cc2ccccc2 2230a_100159249835_100011217306 [0,1,1,0,0,0|2,0,0]=4 507 B16R2.59 FCCN1CCCC1Cc2ccccc2 269982a_100159249835_100011217306 [0,1,1,0,0,0|2,0,0]=4 508 B16R2.59 FCCN1CCCC1Cc2ccccc2 34a_100159249835_100011217306 [0,1,1,0,0,0|2,0,0]=4 509 B16R2.59 OCCN1CCCC1Cc2ccccc2 2230a_100159249835_100000211926 [0,1,1,0,0,0|2,0,0]=4 510 B16R2.59 OCCN1CCCC1Cc2ccccc2 269982a_100159249835_100000211926 [0,1,1,0,0,0|2,0,0]=4 511 B16R2.59 OCCN1CCCC1Cc2ccccc2 34a_100159249835_100000211926 [0,1,1,0,0,0|2,0,0]=4 512 B16R2.59 [13CH3]OC[C@@H]1CCCN1Cc2ccccc2 34a_100011827623_200025704644 [0,1,1,0,0,0|2,0,0]=4 513 B16R2.59 [13CH3]OC[C@@H]1CCCN1Cc2ccccc2 7a_100011827623_200025704644 [0,1,1,0,0,0|2,0,0]=4 514 B16R2.59 [13CH3]SC[C@H]1CCCN1Cc2ccccc2 62a_100015185826_200025704644 [0,1,1,0,0,0|2,0,0]=4 515 B16R2.59 [13CH3]SC[C@H]1CCCN1Cc2ccccc2 62a_200025704644_100015185826 [0,1,1,0,0,0|2,0,0]=4 516 B16R2.168 CCC1CCCN1Cc2cccc(c2)Br 2230a_100000754278_100000698116 [0,1,1,0,0,0|2,0,0]=4 517 B16R2.168 CCC1CCCN1Cc2cccc(c2)Br 269982a_100000754278_100000211773 [0,1,1,0,0,0|2,0,0]=4 518 B16R2.168 CCC1CCCN1Cc2cccc(c2)Br 26a_100000754278_100000210342 [0,1,1,0,0,0|2,0,0]=4 519 B16R2.168 CCC1CCCN1Cc2cccc(c2)Br 270004a_100000754278_100000210085 [0,1,1,0,0,0|2,0,0]=4 520 B16R2.168 CCC1CCCN1Cc2cccc(c2)Br 34a_100000754278_100000698116 [0,1,1,0,0,0|2,0,0]=4 521 B16R2.168 CCC1CCCN1Cc2cccc(c2)C 2230a_100000754278_100000211840 [0,1,1,0,0,0|2,0,0]=4 522 B16R2.168 CCC1CCCN1Cc2cccc(c2)C 269982a_100000754278_100000211840 [0,1,1,0,0,0|2,0,0]=4 523 B16R2.168 CCC1CCCN1Cc2cccc(c2)C 270004a_100000754278_100000211157 [0,1,1,0,0,0|2,0,0]=4 524 B16R2.168 CCC1CCCN1Cc2cccc(c2)C 34a_100000754278_100000211840 [0,1,1,0,0,0|2,0,0]=4 525 B16R2.168 CCC1CCCN1Cc2cccc(c2)Cl 2230a_100000754278_100000181238 [0,1,1,0,0,0|2,0,0]=4 526 B16R2.168 CCC1CCCN1Cc2cccc(c2)Cl 269982a_100000754278_100000181238 [0,1,1,0,0,0|2,0,0]=4 527 B16R2.168 CCC1CCCN1Cc2cccc(c2)Cl 270004a_100000754278_100000210801 [0,1,1,0,0,0|2,0,0]=4 528 B16R2.168 CCC1CCCN1Cc2cccc(c2)Cl 34a_100000754278_100000187163 [0,1,1,0,0,0|2,0,0]=4 529 B16R2.168 CCC1CCCN1Cc2cccc(c2)F 2230a_100000754278_100000230114 [0,1,1,0,0,0|2,0,0]=4 530 B16R2.168 CCC1CCCN1Cc2cccc(c2)F 269982a_100000754278_100000230114 [0,1,1,0,0,0|2,0,0]=4 531 B16R2.168 CCC1CCCN1Cc2cccc(c2)F 270004a_100000754278_100000210812 [0,1,1,0,0,0|2,0,0]=4 532 B16R2.168 CCC1CCCN1Cc2cccc(c2)F 34a_100000754278_100000187166 [0,1,1,0,0,0|2,0,0]=4 533 B16R2.168 CCC1CCCN1Cc2cccc(c2)I 2230a_100000754278_100011218688 [0,1,1,0,0,0|2,0,0]=4 534 B16R2.168 CCC1CCCN1Cc2cccc(c2)I 269982a_100000754278_100011218688 [0,1,1,0,0,0|2,0,0]=4 535 B16R2.168 CCC1CCCN1Cc2cccc(c2)I 270004a_100000754278_100000014684 [0,1,1,0,0,0|2,0,0]=4 536 B16R2.168 CCC1CCCN1Cc2cccc(c2)I 34a_100000754278_100011218688 [0,1,1,0,0,0|2,0,0]=4 537 B16R2.168 CCC1CCCN1Cc2cccc(c2)O 2230a_100000754278_100011660834 [0,1,1,0,0,0|2,0,0]=4 538 B16R2.168 CCC1CCCN1Cc2cccc(c2)O 269982a_100000754278_100000084143 [0,1,1,0,0,0|2,0,0]=4 539 B16R2.168 CCC1CCCN1Cc2cccc(c2)O 270004a_100000754278_100000188321 [0,1,1,0,0,0|2,0,0]=4 540 B16R2.168 CCC1CCCN1Cc2cccc(c2)O 34a_100000754278_100011660834 [0,1,1,0,0,0|2,0,0]=4 541 B16R2.464 CC(=O)C1CCCN1Cc2ccccc2 1458a_100000743216_200000210301 [0,1,1,0,0,0|2,0,0]=4 542 B16R2.464 CC(=O)N1CCCC1Cc2ccccc2 11a_100159249835_100015343762 [0,1,1,0,0,0|2,0,0]=4 543 B16R2.464 CC(=O)N1CCCC1Cc2ccccc2 1626a_100159249835_100015343762 [0,1,1,0,0,0|2,0,0]=4 544 B16R2.464 CC(=O)N1CCCC1Cc2ccccc2 240690a_100159249835_100015343762 [0,1,1,0,0,0|2,0,0]=4 545 B16R2.464 CC(=O)N1CCCC1Cc2ccccc2 527a_100159249835_100103153847 [0,1,1,0,0,0|2,0,0]=4 546 B16R2.464 CC(C)C1CCCN1Cc2ccccc2 2230a_100000762757_100015291786 [0,1,1,0,0,0|2,0,0]=4 547 B16R2.464 CC(C)C1CCCN1Cc2ccccc2 269982a_100000762757_100000211182 [0,1,1,0,0,0|2,0,0]=4 548 B16R2.464 CC(C)C1CCCN1Cc2ccccc2 270004a_100000762757_100015611070 [0,1,1,0,0,0|2,0,0]=4 549 B16R2.464 CC(C)C1CCCN1Cc2ccccc2 34a_100000762757_100015291786 [0,1,1,0,0,0|2,0,0]=4 550 B16R2.464 CC(C)N1CCCC1Cc2ccccc2 2230a_100159249835_100000210206 [0,1,1,0,0,0|2,0,0]=4 551 B16R2.464 CC(C)N1CCCC1Cc2ccccc2 269982a_100159249835_100000210206 [0,1,1,0,0,0|2,0,0]=4 552 B16R2.464 CC(C)N1CCCC1Cc2ccccc2 34a_100159249835_100000210206 [0,1,1,0,0,0|2,0,0]=4 553 B16R2.464 CN(C)C1CCCC1Cc2ccccc2 270004a_100102631434_200000757594 [0,1,1,0,0,0|0,0,0]=2 554 B16R2.464 [13CH3]C(=O)C1CCCN1Cc2ccccc2 1458a_100000743216_200025704644 [0,1,1,0,0,0|2,0,0]=4 555 B16R2.1632 CCC1CCCN1Cc2ccccc2Br 2230a_100000754278_100000184730 [0,1,1,0,0,0|2,0,0]=4 556 B16R2.1632 CCC1CCCN1Cc2ccccc2Br 269982a_100000754278_100000184730 [0,1,1,0,0,0|2,0,0]=4 557 B16R2.1632 CCC1CCCN1Cc2ccccc2Br 26a_100000754278_100000181306 [0,1,1,0,0,0|2,0,0]=4 558 B16R2.1632 CCC1CCCN1Cc2ccccc2Br 270004a_100000754278_100000211189 [0,1,1,0,0,0|2,0,0]=4 559 B16R2.1632 CCC1CCCN1Cc2ccccc2Br 34a_100000754278_100000184730 [0,1,1,0,0,0|2,0,0]=4 560 B16R2.1632 CCC1CCCN1Cc2ccccc2C 2230a_100000754278_100000211839 [0,1,1,0,0,0|2,0,0]=4 561 B16R2.1632 CCC1CCCN1Cc2ccccc2C 269982a_100000754278_100000211839 [0,1,1,0,0,0|2,0,0]=4 562 B16R2.1632 CCC1CCCN1Cc2ccccc2C 270004a_100000754278_100000211143 [0,1,1,0,0,0|2,0,0]=4 563 B16R2.1632 CCC1CCCN1Cc2ccccc2C 34a_100000754278_100000211839 [0,1,1,0,0,0|2,0,0]=4 564 B16R2.1632 CCC1CCCN1Cc2ccccc2Cl 2230a_100000754278_100000187162 [0,1,1,0,0,0|2,0,0]=4 565 B16R2.1632 CCC1CCCN1Cc2ccccc2Cl 269982a_100000754278_100000187162 [0,1,1,0,0,0|2,0,0]=4 566 B16R2.1632 CCC1CCCN1Cc2ccccc2Cl 26a_100000754278_100000210172 [0,1,1,0,0,0|2,0,0]=4 567 B16R2.1632 CCC1CCCN1Cc2ccccc2Cl 270004a_100000754278_100000210073 [0,1,1,0,0,0|2,0,0]=4 568 B16R2.1632 CCC1CCCN1Cc2ccccc2Cl 34a_100000754278_100000187162 [0,1,1,0,0,0|2,0,0]=4 569 B16R2.1632 CCC1CCCN1Cc2ccccc2F 2230a_100000754278_100000211605 [0,1,1,0,0,0|2,0,0]=4 570 B16R2.1632 CCC1CCCN1Cc2ccccc2F 269982a_100000754278_100000211605 [0,1,1,0,0,0|2,0,0]=4 571 B16R2.1632 CCC1CCCN1Cc2ccccc2F 270004a_100000754278_100000210811 [0,1,1,0,0,0|2,0,0]=4 572 B16R2.1632 CCC1CCCN1Cc2ccccc2F 34a_100000754278_100000211605 [0,1,1,0,0,0|2,0,0]=4 573 B16R2.1632 CCC1CCCN1Cc2ccccc2I 2230a_100000754278_100011215278 [0,1,1,0,0,0|2,0,0]=4 574 B16R2.1632 CCC1CCCN1Cc2ccccc2I 269982a_100000754278_100011215278 [0,1,1,0,0,0|2,0,0]=4 575 B16R2.1632 CCC1CCCN1Cc2ccccc2I 270004a_100000754278_100000010305 [0,1,1,0,0,0|2,0,0]=4 576 B16R2.1632 CCC1CCCN1Cc2ccccc2I 34a_100000754278_100011215278 [0,1,1,0,0,0|2,0,0]=4 577 B16R2.1632 CCN1CCCC1Cc2ccccc2C 2230a_100000755832_100000210202 [0,1,1,0,0,0|2,0,0]=4 578 B16R2.1632 CCN1CCCC1Cc2ccccc2C 269982a_100000755832_100000204670 [0,1,1,0,0,0|2,0,0]=4 579 B16R2.1632 CCN1CCCC1Cc2ccccc2C 34a_100000755832_100000210202 [0,1,1,0,0,0|2,0,0]=4 580 B16R2.1632 CCN1CCCC1Cc2ccccc2Cl 2230a_100000744037_100000210202 [0,1,1,0,0,0|2,0,0]=4 581 B16R2.1632 CCN1CCCC1Cc2ccccc2Cl 269982a_100000744037_100000204670 [0,1,1,0,0,0|2,0,0]=4 582 B16R2.1632 CCN1CCCC1Cc2ccccc2Cl 34a_100000744037_100000210202 [0,1,1,0,0,0|2,0,0]=4 583 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Br 2230a_100000754278_100011217064 [0,1,1,0,0,0|2,0,0]=4 584 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Br 269982a_100000754278_100011217064 [0,1,1,0,0,0|2,0,0]=4 585 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Br 26a_100000754278_100000185759 [0,1,1,0,0,0|2,0,0]=4 586 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Br 270004a_100000754278_100000186029 [0,1,1,0,0,0|2,0,0]=4 587 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Br 34a_100000754278_100000189115 [0,1,1,0,0,0|2,0,0]=4 588 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)C 2230a_100000754278_100000210814 [0,1,1,0,0,0|2,0,0]=4 589 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)C 269982a_100000754278_100000210814 [0,1,1,0,0,0|2,0,0]=4 590 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)C 26a_100000754278_200020625495 [0,1,1,0,0,0|2,0,0]=4 591 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)C 270004a_100000754278_100000211033 [0,1,1,0,0,0|2,0,0]=4 592 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)C 34a_100000754278_100000210814 [0,1,1,0,0,0|2,0,0]=4 593 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Cl 2230a_100000754278_100000694040 [0,1,1,0,0,0|2,0,0]=4 594 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Cl 269982a_100000754278_100000187161 [0,1,1,0,0,0|2,0,0]=4 595 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Cl 270004a_100000754278_100000189385 [0,1,1,0,0,0|2,0,0]=4 596 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)Cl 34a_100000754278_100000694040 [0,1,1,0,0,0|2,0,0]=4 597 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)F 2230a_100000754278_100000198546 [0,1,1,0,0,0|2,0,0]=4 598 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)F 269982a_100000754278_100000198546 [0,1,1,0,0,0|2,0,0]=4 599 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)F 270004a_100000754278_100000210084 [0,1,1,0,0,0|2,0,0]=4 600 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)F 34a_100000754278_100000198546 [0,1,1,0,0,0|2,0,0]=4 601 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)I 2230a_100000754278_100000189116 [0,1,1,0,0,0|2,0,0]=4 602 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)I 269982a_100000754278_100000189116 [0,1,1,0,0,0|2,0,0]=4 603 B16R2.2244 CCC1CCCN1Cc2ccc(cc2)I 34a_100000754278_100000189116 [0,1,1,0,0,0|2,0,0]=4 604 B16R2.2244 CCN1CCCC1Cc2ccc(cc2)C 2230a_100000755604_100000210202 [0,1,1,0,0,0|2,0,0]=4 605 B16R2.2244 CCN1CCCC1Cc2ccc(cc2)C 269982a_100000755604_100000204670 [0,1,1,0,0,0|2,0,0]=4 606 B16R2.2244 CCN1CCCC1Cc2ccc(cc2)C 34a_100000755604_100000210202 [0,1,1,0,0,0|2,0,0]=4 607 B16R2.2516 CCC1CCCN1C(C)c2ccccc2 2230a_100000754278_100000230085 [0,1,1,0,0,0|2,0,0]=4 608 B16R2.2516 CCC1CCCN1C(C)c2ccccc2 269982a_100000754278_100000230085 [0,1,1,0,0,0|2,0,0]=4 609 B16R2.2516 CCC1CCCN1C(C)c2ccccc2 34a_100000754278_100000211855 [0,1,1,0,0,0|2,0,0]=4 610 B16R2.100 C=CCN(c1ccccc1)C2CCCC2 2230a_100000211662_100000179811 [0,1,1,0,0,0|2,0,0]=4 611 B16R2.100 C=CCN(c1ccccc1)C2CCCC2 269982a_100000211662_100000179811 [0,1,1,0,0,0|2,0,0]=4 612 B16R2.100 C=CCN(c1ccccc1)C2CCCC2 34a_100000211662_100000179811 [0,1,1,0,0,0|2,0,0]=4 613 B16R2.100 CCCN(c1ccccc1)C2CCCC2 2230a_200011218496_100000179811 [0,1,1,0,0,0|2,0,0]=4 614 B16R2.100 CCCN(c1ccccc1)C2CCCC2 269982a_200011218496_100000179811 [0,1,1,0,0,0|2,0,0]=4 615 B16R2.100 CCCN(c1ccccc1)C2CCCC2 34a_200011218496_100000179811 [0,1,1,0,0,0|2,0,0]=4 616 B16R2.100 CCNC(c1ccccc1)C2CCCC2 2230a_100000746738_100000210202 [0,1,1,0,0,0|1,0,0]=3 617 B16R2.100 CCNC(c1ccccc1)C2CCCC2 269862a_100015525214_100000753715 [0,1,1,0,0,0|1,0,0]=3 618 B16R2.100 CCNC(c1ccccc1)C2CCCC2 34a_100000746738_100000210202 [0,1,1,0,0,0|1,0,0]=3 619 B16R2.100 CCNC(c1ccccc1)C2CCNC2 269862a_100015525214_100015189469 [0,1,1,0,0,0|2,0,0]=4 620 B16R2.100 CCNC(c1ccccn1)C2CCCC2 269862a_100015525214_100000764701 [0,1,1,0,0,0|2,0,0]=4 621 B16R2.100 ClCCC(c1ccccc1)N2CCCC2 2230a_100000188435_200010132975 [0,1,1,0,0,0|2,0,0]=4 622 B16R2.100 ClCCC(c1ccccc1)N2CCCC2 269982a_100000188435_200010132975 [0,1,1,0,0,0|2,0,0]=4 623 B16R2.100 FCNC(c1ccccc1)C2CCCC2 34a_100000746738_100015361967 [0,1,1,0,0,0|1,0,0]=3 624 B16R2.100 OCCN(c1ccccc1)C2CCCC2 2230a_100000211345_100000179811 [0,1,1,0,0,0|2,0,0]=4 625 B16R2.100 OCCN(c1ccccc1)C2CCCC2 269982a_100000211345_100000179811 [0,1,1,0,0,0|2,0,0]=4 626 B16R2.100 OCCN(c1ccccc1)C2CCCC2 34a_100000211345_100000179811 [0,1,1,0,0,0|2,0,0]=4 627 B16R2.189 CCN(c1ccc(cc1)Br)C2CCCC2 2230a_100000219632_100000179811 [0,1,1,0,0,0|2,0,0]=4 628 B16R2.189 CCN(c1ccc(cc1)Br)C2CCCC2 269982a_100000219632_100000179811 [0,1,1,0,0,0|2,0,0]=4 629 B16R2.189 CCN(c1ccc(cc1)Br)C2CCCC2 34a_100000219632_100000179811 [0,1,1,0,0,0|2,0,0]=4 630 B16R2.189 CCN(c1ccc(cc1)C)C2CCCC2 2230a_100000219985_100000179811 [0,1,1,0,0,0|2,0,0]=4 631 B16R2.189 CCN(c1ccc(cc1)C)C2CCCC2 269982a_100000219985_100000179811 [0,1,1,0,0,0|2,0,0]=4 632 B16R2.189 CCN(c1ccc(cc1)C)C2CCCC2 34a_100000219985_100000179811 [0,1,1,0,0,0|2,0,0]=4 633 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 2230a_100000220165_100000179811 [0,1,1,0,0,0|2,0,0]=4 634 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 2230a_100000713107_100000210202 [0,1,1,0,0,0|2,0,0]=4 635 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 269982a_100000220165_100000179811 [0,1,1,0,0,0|2,0,0]=4 636 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 269982a_100000713107_100000204670 [0,1,1,0,0,0|2,0,0]=4 637 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 34a_100000220165_100000179811 [0,1,1,0,0,0|2,0,0]=4 638 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 34a_100000713107_100000210202 [0,1,1,0,0,0|2,0,0]=4 639 B16R2.189 CCN(c1ccc(cc1)Cl)C2CCCC2 7a_100000713107_100000210202 [0,1,1,0,0,0|2,0,0]=4 640 B16R2.189 CCN(c1ccc(cc1)F)C2CCCC2 2230a_100102640331_100000179811 [0,1,1,0,0,0|2,0,0]=4 641 B16R2.189 CCN(c1ccc(cc1)F)C2CCCC2 269982a_100102640331_100000179811 [0,1,1,0,0,0|2,0,0]=4 642 B16R2.189 CCN(c1ccc(cc1)F)C2CCCC2 34a_100102640331_100000179811 [0,1,1,0,0,0|2,0,0]=4 643 B16R2.189 CCN(c1ccc(cc1)O)C2CCCC2 2230a_100011337800_100000179811 [0,1,1,0,0,0|2,0,0]=4 644 B16R2.189 CCN(c1ccc(cc1)O)C2CCCC2 269982a_100011337800_100000179811 [0,1,1,0,0,0|2,0,0]=4 645 B16R2.189 CCN(c1ccc(cc1)O)C2CCCC2 34a_100011337800_100000179811 [0,1,1,0,0,0|2,0,0]=4 646 B16R2.189 CNC(c1ccc(cc1)F)C2CCCC2 2230a_200000740548_200000210301 [0,1,1,0,0,0|2,0,0]=4 647 B16R2.189 CNC(c1ccc(cc1)F)C2CCCC2 34a_200000740548_200000210301 [0,1,1,0,0,0|2,0,0]=4 648 B16R2.189 FCN(c1ccc(cc1)Cl)C2CCCC2 269982a_100000713107_100015361967 [0,1,1,0,0,0|2,0,0]=4 649 B16R2.189 FCN(c1ccc(cc1)Cl)C2CCCC2 34a_100000713107_100015361967 [0,1,1,0,0,0|2,0,0]=4 650 B16R2.189 FCN(c1ccc(cc1)Cl)C2CCCC2 7a_100000713107_100015361967 [0,1,1,0,0,0|2,0,0]=4 651 B16R2.189 [13CH3]NC(c1ccc(cc1)F)C2CCCC2 2230a_200000740548_200025704644 [0,1,1,0,0,0|2,0,0]=4 652 B16R2.189 [13CH3]NC(c1ccc(cc1)F)C2CCCC2 34a_200000740548_200025704644 [0,1,1,0,0,0|2,0,0]=4 653 B16R2.519 CC(=O)C(c1ccccc1)C2CCCC2 1458a_100011218497_200000210301 [0,1,1,0,0,0|1,0,1]=4 654 B16R2.519 CC(C)N(c1ccccc1)C2CCCC2 2230a_100000210572_100000179811 [0,1,1,0,0,0|2,0,0]=4 655 B16R2.519 CC(C)N(c1ccccc1)C2CCCC2 269982a_100000210572_100000179811 [0,1,1,0,0,0|2,0,0]=4 656 B16R2.519 CC(C)N(c1ccccc1)C2CCCC2 34a_100000210572_100000179811 [0,1,1,0,0,0|2,0,0]=4 657 B16R2.519 CC(C)N(c1ccccc1)C2CCCC2 7a_100000210572_100000179811 [0,1,1,0,0,0|2,0,0]=4 658 B16R2.519 NC(=O)C(c1ccccc1)N2CCCC2 2230a_100000188435_100000188848 [0,1,1,0,0,0|1,0,1]=4 659 B16R2.519 NC(=O)C(c1ccccc1)N2CCCC2 269982a_100000188435_100000188848 [0,1,1,0,0,0|1,0,1]=4 660 B16R2.519 [13CH3]C(=O)C(c1ccccc1)C2CCCC2 1458a_100011218497_200025704644 [0,1,1,0,0,0|1,0,1]=4 661 B16R2.2217 CCC(c1ccccc1)C2CCCN2C 2230a_100000765727_200000210301 [0,1,1,0,0,0|2,0,0]=4 662 B16R2.2217 CCC(c1ccccc1)C2CCCN2C 269982a_100000765727_200000210301 [0,1,1,0,0,0|2,0,0]=4 663 B16R2.2217 CCC(c1ccccc1)C2CCCN2C 34a_100000765727_200000210301 [0,1,1,0,0,0|2,0,0]=4 664 B16R2.2217 CCC(c1ccccc1)C2CCCN2[13CH3] 2230a_100000765727_200025704644 [0,1,1,0,0,0|2,0,0]=4 665 B16R2.2217 CCC(c1ccccc1)C2CCCN2[13CH3] 269982a_100000765727_200025704644 [0,1,1,0,0,0|2,0,0]=4 666 B16R2.2217 CCC(c1ccccc1)C2CCCN2[13CH3] 34a_100000765727_200025704644 [0,1,1,0,0,0|2,0,0]=4 667 B16R2.2217 CCN(c1ccccc1)[C@@H]2CCC[C@H]2O 269982a_100000210013_200016002552 [0,1,1,0,0,0|2,0,0]=4 668 B16R2.2222 CCN(c1cccc(c1)Br)C2CCCC2 2230a_100000738899_100000179811 [0,1,1,0,0,0|2,0,0]=4 669 B16R2.2222 CCN(c1cccc(c1)Br)C2CCCC2 269982a_100000738899_100000179811 [0,1,1,0,0,0|2,0,0]=4 670 B16R2.2222 CCN(c1cccc(c1)Br)C2CCCC2 34a_100000738899_100000179811 [0,1,1,0,0,0|2,0,0]=4 671 B16R2.2222 CCN(c1cccc(c1)C)C2CCCC2 2230a_100000182157_100000179811 [0,1,1,0,0,0|2,0,0]=4 672 B16R2.2222 CCN(c1cccc(c1)C)C2CCCC2 269982a_100000182157_100000179811 [0,1,1,0,0,0|2,0,0]=4 673 B16R2.2222 CCN(c1cccc(c1)C)C2CCCC2 34a_100000182157_100000179811 [0,1,1,0,0,0|2,0,0]=4 674 B16R2.2222 CCN(c1cccc(c1)C)C2CCCC2 7a_100000182157_100000179811 [0,1,1,0,0,0|2,0,0]=4 675 B16R2.2222 CCN(c1cccc(c1)O)C2CCCC2 2230a_100000717746_100000179811 [0,1,1,0,0,0|2,0,0]=4 676 B16R2.2222 CCN(c1cccc(c1)O)C2CCCC2 269982a_100000717746_100000179811 [0,1,1,0,0,0|2,0,0]=4 677 B16R2.2222 CCN(c1cccc(c1)O)C2CCCC2 34a_100000717746_100000179811 [0,1,1,0,0,0|2,0,0]=4 678 B16R2.5483 CCN(c1ccccc1Br)C2CCCC2 2230a_114873767003_100000179811 [0,1,1,0,0,0|2,0,0]=4 679 B16R2.5483 CCN(c1ccccc1Br)C2CCCC2 269982a_114873767003_100000179811 [0,1,1,0,0,0|2,0,0]=4 680 B16R2.5483 CCN(c1ccccc1Br)C2CCCC2 34a_114873767003_100000179811 [0,1,1,0,0,0|2,0,0]=4 681 B16R2.5483 CCN(c1ccccc1C)C2CCCC2 2230a_100000211084_100000179811 [0,1,1,0,0,0|2,0,0]=4 682 B16R2.5483 CCN(c1ccccc1C)C2CCCC2 269982a_100000211084_100000179811 [0,1,1,0,0,0|2,0,0]=4 683 B16R2.5483 CCN(c1ccccc1C)C2CCCC2 34a_100000211084_100000179811 [0,1,1,0,0,0|2,0,0]=4 684 B16R2.5483 CCN(c1ccccc1F)C2CCCC2 2230a_100000220365_100000179811 [0,1,1,0,0,0|2,0,0]=4 685 B16R2.5483 CCN(c1ccccc1F)C2CCCC2 269982a_100000220365_100000179811 [0,1,1,0,0,0|2,0,0]=4 686 B16R2.5483 CCN(c1ccccc1F)C2CCCC2 34a_100000220365_100000179811 [0,1,1,0,0,0|2,0,0]=4 687 B16R2.5483 CCN(c1ccccc1O)C2CCCC2 269982a_103624766699_100000179811 [0,1,1,0,0,0|2,0,0]=4 688 B16R2.5483 CNC(c1ccccc1Cl)C2CCCC2 269862a_106832991636_200011219683 [0,1,1,0,0,0|2,0,0]=4 689 B16R2.5483 CNC(c1ccccc1F)C2CCCC2 269862a_106832991636_100000688463 [0,1,1,0,0,0|2,0,0]=4 690 B16R2.1084 CC(c1ccc(cc1)Br)N2CCC[C@@H]2C 2230a_100020605311_100000755118 [0,1,1,0,0,0|2,0,0]=4 691 B16R2.1084 CC(c1ccc(cc1)Br)N2CCC[C@@H]2C 269982a_100020605311_100000755118 [0,1,1,0,0,0|2,0,0]=4 692 B16R2.1084 CC(c1ccc(cc1)Br)N2CCC[C@H]2C 2230a_100015189458_100000755118 [0,1,1,0,0,0|2,0,0]=4 693 B16R2.1084 CC(c1ccc(cc1)Br)N2CCC[C@H]2C 269982a_100015189458_100000755118 [0,1,1,0,0,0|2,0,0]=4 694 B16R2.1084 CC(c1ccc(cc1)Br)N2CCC[C@H]2C 34a_100015189458_100000755118 [0,1,1,0,0,0|2,0,0]=4 695 B16R2.1084 CC(c1ccc(cc1)Cl)N2CCC[C@@H]2C 2230a_100020605311_100000684792 [0,1,1,0,0,0|2,0,0]=4 696 B16R2.1084 CC(c1ccc(cc1)Cl)N2CCC[C@@H]2C 269982a_100020605311_100000684792 [0,1,1,0,0,0|2,0,0]=4 697 B16R2.1084 CC(c1ccc(cc1)Cl)N2CCC[C@H]2C 2230a_100015189458_100000684792 [0,1,1,0,0,0|2,0,0]=4 698 B16R2.1084 CC(c1ccc(cc1)Cl)N2CCC[C@H]2C 269982a_100015189458_100000684792 [0,1,1,0,0,0|2,0,0]=4 699 B16R2.1084 CC(c1ccc(cc1)F)N2CCC[C@@H]2C 2230a_100020605311_100000743420 [0,1,1,0,0,0|2,0,0]=4 700 B16R2.1084 CC(c1ccc(cc1)F)N2CCC[C@@H]2C 269982a_100020605311_100000743420 [0,1,1,0,0,0|2,0,0]=4 701 B16R2.1084 CC(c1ccc(cc1)F)N2CCC[C@H]2C 2230a_100015189458_100000743420 [0,1,1,0,0,0|2,0,0]=4 702 B16R2.1084 CC(c1ccc(cc1)F)N2CCC[C@H]2C 269982a_100015189458_100000743420 [0,1,1,0,0,0|2,0,0]=4 703 B16R2.1084 CC(c1ccc(cc1)F)N2CCC[C@H]2C 34a_100015189458_100000743420 [0,1,1,0,0,0|2,0,0]=4 704 B16R2.1084 CN(c1ccc(cc1)Br)[C@@H]2CCC[C@H]2O 269982a_100000219623_200016002552 [0,1,1,0,0,0|2,0,0]=4 705 B16R2.1084 CN(c1ccc(cc1)Cl)[C@@H]2CCC[C@H]2O 269982a_100020629279_200016002552 [0,1,1,0,0,0|2,0,0]=4 706 B16R2.1084 CN(c1ccc(cc1)F)[C@@H]2CCC[C@H]2O 269982a_100000219829_200016002552 [0,1,1,0,0,0|2,0,0]=4 707 B16R2.1084 CN(c1ccc(cc1)I)[C@@H]2CCC[C@H]2O 269982a_100000743151_200016002552 [0,1,1,0,0,0|2,0,0]=4 708 B16R2.1084 CN(c1ccc(cc1)O)[C@@H]2CCC[C@H]2O 269982a_100000182112_200016002552 [0,1,1,0,0,0|2,0,0]=4 709 B16R2.1084 Cc1ccc(cc1)C(C)N2CCC[C@@H]2C 2230a_100020605311_100011261388 [0,1,1,0,0,0|2,0,0]=4 710 B16R2.1084 Cc1ccc(cc1)C(C)N2CCC[C@@H]2C 269982a_100020605311_100011261388 [0,1,1,0,0,0|2,0,0]=4 711 B16R2.1084 Cc1ccc(cc1)C(C)N2CCC[C@H]2C 2230a_100015189458_100011261388 [0,1,1,0,0,0|2,0,0]=4 712 B16R2.1084 Cc1ccc(cc1)C(C)N2CCC[C@H]2C 269982a_100015189458_100011261388 [0,1,1,0,0,0|2,0,0]=4 713 B16R2.1084 Cc1ccc(cc1)C(C)N2CCC[C@H]2C 34a_100015189458_100011261388 [0,1,1,0,0,0|2,0,0]=4 714 B16R2.1084 Cc1ccc(cc1)N(C)C2CCCC2C 2230a_200000711169_200000210301 [0,1,1,0,0,0|2,0,0]=4 715 B16R2.1084 Cc1ccc(cc1)N(C)C2CCCC2C 269982a_200000711169_200000210301 [0,1,1,0,0,0|2,0,0]=4 716 B16R2.1084 Cc1ccc(cc1)N(C)C2CCCC2C 34a_200000711169_200000210301 [0,1,1,0,0,0|2,0,0]=4 717 B16R2.1084 Cc1ccc(cc1)N(C)C2CCCC2C 7a_200000711169_200000210301 [0,1,1,0,0,0|2,0,0]=4 718 B16R2.1084 Cc1ccc(cc1)N(C)[C@@H]2CCC[C@H]2O 269982a_100000219977_200016002552 [0,1,1,0,0,0|2,0,0]=4 719 B16R2.1084 Cc1ccc(cc1)N([13CH3])C2CCCC2C 2230a_200000711169_200025704644 [0,1,1,0,0,0|2,0,0]=4 720 B16R2.1084 Cc1ccc(cc1)N([13CH3])C2CCCC2C 269982a_200000711169_200025704644 [0,1,1,0,0,0|2,0,0]=4 721 B16R2.1084 Cc1ccc(cc1)N([13CH3])C2CCCC2C 34a_200000711169_200025704644 [0,1,1,0,0,0|2,0,0]=4 722 B16R2.1084 Cc1ccc(cc1)N([13CH3])C2CCCC2C 7a_200000711169_200025704644 [0,1,1,0,0,0|2,0,0]=4 723 B16R2.3022 C[C@@H]1CCCN1C(C)(C)c2ccccc2 2230a_100015189458_100000034625 [0,1,1,0,0,0|2,0,0]=4 724 B16R2.3022 C[C@@H]1CCCN1C(C)(C)c2ccccc2 269982a_100015189458_100000034625 [0,1,1,0,0,0|2,0,0]=4 725 B16R2.3022 C[C@H]1CCCN1C(C)(C)c2ccccc2 2230a_100020605311_100000034625 [0,1,1,0,0,0|2,0,0]=4 726 B16R2.3022 C[C@H]1CCCN1C(C)(C)c2ccccc2 269982a_100020605311_100000034625 [0,1,1,0,0,0|2,0,0]=4 727 B16R2.5948 CC1CCC(N1C(C)c2ccccc2)C 2230a_100000687148_100000230085 [0,1,1,0,0,0|2,0,0]=4 728 B16R2.5948 CC1CCC(N1C(C)c2ccccc2)C 269982a_100000687148_100000230085 [0,1,1,0,0,0|2,0,0]=4 729 B16R2.5948 CC1CCC(N1C(C)c2ccccc2)C 34a_100000687148_100000211855 [0,1,1,0,0,0|2,0,0]=4 730 B16R2.6779 CC(c1ccccc1)N2CCCC2(C)C 2230a_100000761399_100000230085 [0,1,1,0,0,0|2,0,0]=4 731 B16R2.6779 CC(c1ccccc1)N2CCCC2(C)C 269982a_100000761399_100000230085 [0,1,1,0,0,0|2,0,0]=4 732 B16R2.6779 CC(c1ccccc1)N2CCCC2(C)C 34a_100000761399_100000211855 [0,1,1,0,0,0|2,0,0]=4 733 B16R2.6779 CN(c1ccccc1)C2CCCC2(F)F 269982a_100000210012_100119073726 [0,1,1,0,0,0|2,0,0]=4 734 B16R2.6779 CN(c1ccccc1)C2CCCC2(F)F 34a_100000210012_100119073726 [0,1,1,0,0,0|2,0,0]=4 735 B16R2.22598 CC(c1ccccc1Cl)N2CCC[C@@H]2C 2230a_100020605311_100000181259 [0,1,1,0,0,0|2,0,0]=4 736 B16R2.22598 CC(c1ccccc1Cl)N2CCC[C@@H]2C 269982a_100020605311_100000181259 [0,1,1,0,0,0|2,0,0]=4 737 B16R2.22598 CC(c1ccccc1Cl)N2CCC[C@H]2C 2230a_100015189458_100000181259 [0,1,1,0,0,0|2,0,0]=4 738 B16R2.22598 CC(c1ccccc1Cl)N2CCC[C@H]2C 269982a_100015189458_100000181259 [0,1,1,0,0,0|2,0,0]=4 739 B16R2.22598 CC(c1ccccc1F)N2CCC[C@@H]2C 2230a_100020605311_200000741388 [0,1,1,0,0,0|2,0,0]=4 740 B16R2.22598 CC(c1ccccc1F)N2CCC[C@@H]2C 269982a_100020605311_200000741388 [0,1,1,0,0,0|2,0,0]=4 741 B16R2.22598 CC(c1ccccc1F)N2CCC[C@H]2C 2230a_100015189458_200000741388 [0,1,1,0,0,0|2,0,0]=4 742 B16R2.22598 CC(c1ccccc1F)N2CCC[C@H]2C 269982a_100015189458_200000741388 [0,1,1,0,0,0|2,0,0]=4 743 B16R2.22598 CC(c1ccccc1F)N2CCC[C@H]2C 34a_100015189458_200000741388 [0,1,1,0,0,0|2,0,0]=4 744 B16R2.22598 CN(c1ccccc1Br)[C@@H]2CCC[C@H]2O 269982a_100020606079_200016002552 [0,1,1,0,0,0|2,0,0]=4 745 B16R2.22598 CN(c1ccccc1Cl)[C@@H]2CCC[C@H]2O 269982a_100000219374_200016002552 [0,1,1,0,0,0|2,0,0]=4 746 B16R2.22598 CN(c1ccccc1F)[C@@H]2CCC[C@H]2O 269982a_100000220357_200016002552 [0,1,1,0,0,0|2,0,0]=4 747 B16R2.22598 CN(c1ccccc1O)[C@@H]2CCC[C@H]2O 269982a_100000033821_200016002552 [0,1,1,0,0,0|2,0,0]=4 748 B16R2.22598 Cc1ccccc1N(C)[C@@H]2CCC[C@H]2O 269982a_100000219699_200016002552 [0,1,1,0,0,0|2,0,0]=4 749 B16R2.25698 CN(c1cccc(c1)Br)[C@@H]2CCC[C@H]2O 269982a_100000219648_200016002552 [0,1,1,0,0,0|2,0,0]=4 750 B16R2.25698 CN(c1cccc(c1)Cl)[C@@H]2CCC[C@H]2O 269982a_100000220044_200016002552 [0,1,1,0,0,0|2,0,0]=4 751 B16R2.25698 CN(c1cccc(c1)F)[C@@H]2CCC[C@H]2O 269982a_100020633736_200016002552 [0,1,1,0,0,0|2,0,0]=4 752 B16R2.25698 CN(c1cccc(c1)I)[C@@H]2CCC[C@H]2O 269982a_100000221217_200016002552 [0,1,1,0,0,0|2,0,0]=4 753 B16R2.25698 CN(c1cccc(c1)O)[C@@H]2CCC[C@H]2O 269982a_100000756613_200016002552 [0,1,1,0,0,0|2,0,0]=4 754 B16R2.25698 Cc1cccc(c1)N(C)[C@@H]2CCC[C@H]2O 269982a_100000219674_200016002552 [0,1,1,0,0,0|2,0,0]=4 755 B16R2.135 Brc1ccc(cc1)C=NNC2CCCC2 4a_100000737850_100000186029 [0,1,1,0,0,0|1,0,1]=4 756 B16R2.135 Brc1ccc(cc1)CCCN2CCCC2 2230a_100000188435_100011713682 [0,1,1,0,0,0|2,0,0]=4 757 B16R2.135 Brc1ccc(cc1)CCCN2CCCC2 269982a_100000188435_100011713682 [0,1,1,0,0,0|2,0,0]=4 758 B16R2.135 Brc1ccc(cc1)CCNC2CC=CC2 2230a_100015188752_100011740612 [0,1,1,0,0,0|0,0,2]=4 759 B16R2.135 Brc1ccc(cc1)CCNC2CCCC2 2230a_100000211070_100011740612 [0,1,1,0,0,0|0,0,0]=2 760 B16R2.135 Brc1ccc(cc1)CCNC2CCCC2 2230a_100000755846_100000179811 [0,1,1,0,0,0|0,0,0]=2 761 B16R2.135 Brc1ccc(cc1)CCNC2CCCC2 270004a_100000755846_100000210133 [0,1,1,0,0,0|0,0,0]=2 762 B16R2.135 Brc1ccc(cc1)CCNC2CCCC2 34a_100000211070_100011740612 [0,1,1,0,0,0|0,0,0]=2 763 B16R2.135 Brc1ccc(cc1)CCNC2CCCC2 34a_100000755846_100000179811 [0,1,1,0,0,0|0,0,0]=2 764 B16R2.135 Brc1ccc(cc1)CCNC2CCOC2 2230a_100000755846_100000731011 [0,1,1,0,0,0|1,0,0]=3 765 B16R2.135 Brc1ccc(cc1)CCNC2CCOC2 270004a_100000755846_100000752484 [0,1,1,0,0,0|1,0,0]=3 766 B16R2.135 Brc1ccc(cc1)CCNC2CCOC2 34a_100000755846_100000690089 [0,1,1,0,0,0|1,0,0]=3 767 B16R2.135 Brc1ccc(cc1)CCNC2CCSC2 270004a_100000755846_100000212027 [0,1,1,0,0,0|1,0,0]=3 768 B16R2.135 Brc1ccc(cc1)CCN[C@@H]2CCOC2 2230a_200015188469_100011740612 [0,1,1,0,0,0|1,0,0]=3 769 B16R2.135 Brc1ccc(cc1)CCN[C@H]2CCOC2 2230a_100015188467_100011740612 [0,1,1,0,0,0|1,0,0]=3 770 B16R2.135 Brc1ccc(cc1)CCN[C@H]2CCOC2 34a_100015188467_100011740612 [0,1,1,0,0,0|1,0,0]=3 771 B16R2.135 Brc1ccc(cc1)CCOC2CCCC2 34a_100000210269_100011740612 [0,1,1,0,0,0|1,0,0]=3 772 B16R2.135 Brc1ccc(cc1)CCOC2CCCC2 34a_100000766406_100000179811 [0,1,1,0,0,0|1,0,0]=3 773 B16R2.135 Brc1ccc(cc1)CCOC2CCCC2 7a_100000210269_100011740612 [0,1,1,0,0,0|1,0,0]=3 774 B16R2.135 Brc1ccc(cc1)CCOC2CCCC2 7a_100000766406_100000179811 [0,1,1,0,0,0|1,0,0]=3 775 B16R2.135 Brc1ccc(cc1)CCOC2CCCO2 34a_100000085407_100011740612 [0,1,1,0,0,0|2,0,0]=4 776 B16R2.135 Brc1ccc(cc1)CCOC2CCOC2 34a_100000766406_100000690089 [0,1,1,0,0,0|2,0,0]=4 777 B16R2.135 Brc1ccc(cc1)CCOC2CCOC2 7a_100000766406_100000731011 [0,1,1,0,0,0|2,0,0]=4 778 B16R2.135 Brc1ccc(cc1)CCOC2CCSC2 7a_100011232664_100011740612 [0,1,1,0,0,0|2,0,0]=4 779 B16R2.135 Brc1ccc(cc1)CCO[C@H]2CCOC2 34a_100000717292_100011740612 [0,1,1,0,0,0|2,0,0]=4 780 B16R2.135 Brc1ccc(cc1)CCSC2CCCC2 62a_100011217020_100011740612 [0,1,1,0,0,0|1,0,0]=3 781 B16R2.135 Brc1ccc(cc1)CCSC2CCCC2 62a_100011740612_100000179811 [0,1,1,0,0,0|1,0,0]=3 782 B16R2.135 Brc1ccc(cc1)CCSC2CCOC2 62a_100011740612_100000690089 [0,1,1,0,0,0|2,0,0]=4 783 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 207a_100000737975_100000186029 [0,1,1,0,0,0|2,0,0]=4 784 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 2230a_100000174875_100000740388 [0,1,1,0,0,0|2,0,0]=4 785 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 2230a_100000737975_100011217064 [0,1,1,0,0,0|2,0,0]=4 786 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 269862a_100000174875_100000746403 [0,1,1,0,0,0|2,0,0]=4 787 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 270004a_100000737975_100000186029 [0,1,1,0,0,0|2,0,0]=4 788 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 34a_100000174875_100000740388 [0,1,1,0,0,0|2,0,0]=4 789 B16R2.135 Brc1ccc(cc1)CNCC2CCCC2 34a_100000737975_100000189115 [0,1,1,0,0,0|2,0,0]=4 790 B16R2.135 Brc1ccc(cc1)COCC2CCCC2 34a_100000695286_100000740388 [0,1,1,0,0,0|2,0,0]=4 791 B16R2.135 Brc1ccc(cc1)COCC2CCCC2 34a_100000742336_100000189115 [0,1,1,0,0,0|2,0,0]=4 792 B16R2.135 Brc1ccc(cc1)COCC2CCCC2 7a_100000742336_100011217064 [0,1,1,0,0,0|2,0,0]=4 793 B16R2.135 Brc1ccc(cc1)CSCC2CCCC2 62a_100000189115_100000740388 [0,1,1,0,0,0|2,0,0]=4 794 B16R2.135 Brc1ccc(cc1)CSCC2CCCC2 62a_100000740388_100000189115 [0,1,1,0,0,0|2,0,0]=4 795 B16R2.135 Brc1ccc(cc1)NCCC2CCCC2 2230a_100000210018_100000760354 [0,1,1,0,0,0|2,0,0]=4 796 B16R2.135 Brc1ccc(cc1)NCCC2CCCC2 34a_100000210018_100000760354 [0,1,1,0,0,0|2,0,0]=4 797 B16R2.135 Brc1ccc(cc1)OCCC2CCCC2 34a_100000185759_100000760354 [0,1,1,0,0,0|2,0,0]=4 798 B16R2.135 Brc1ccc(cc1)OCCC2CCCC2 7a_100000185759_100000760354 [0,1,1,0,0,0|2,0,0]=4 799 B16R2.135 Brc1ccc(cc1)SCCC2CCCC2 62a_100000752885_100000760354 [0,1,1,0,0,0|2,0,0]=4 800 B16R2.135 Brc1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000752885 [0,1,1,0,0,0|2,0,0]=4 801 B16R2.135 Brc1ccc(nc1)CCOC2CCCC2 34a_100012357577_100000179811 [0,1,1,0,0,0|2,0,0]=4 802 B16R2.135 Cc1ccc(cc1)C=NNC2CCCC2 4a_100000737850_100000211033 [0,1,1,0,0,0|1,0,1]=4 803 B16R2.135 Cc1ccc(cc1)CCNC2CC=CC2 2230a_100015188752_100011713686 [0,1,1,0,0,0|0,0,2]=4 804 B16R2.135 Cc1ccc(cc1)CCNC2CCCC2 2230a_100000211070_100011713686 [0,1,1,0,0,0|0,0,0]=2 805 B16R2.135 Cc1ccc(cc1)CCNC2CCCC2 2230a_100000705350_100000179811 [0,1,1,0,0,0|0,0,0]=2 806 B16R2.135 Cc1ccc(cc1)CCNC2CCCC2 270004a_100000705350_100000210133 [0,1,1,0,0,0|0,0,0]=2 807 B16R2.135 Cc1ccc(cc1)CCNC2CCCC2 34a_100000211070_100011713686 [0,1,1,0,0,0|0,0,0]=2 808 B16R2.135 Cc1ccc(cc1)CCNC2CCCC2 34a_100000705350_100000179811 [0,1,1,0,0,0|0,0,0]=2 809 B16R2.135 Cc1ccc(cc1)CCNC2CCOC2 2230a_100000705350_100000731011 [0,1,1,0,0,0|1,0,0]=3 810 B16R2.135 Cc1ccc(cc1)CCNC2CCOC2 270004a_100000705350_100000752484 [0,1,1,0,0,0|1,0,0]=3 811 B16R2.135 Cc1ccc(cc1)CCNC2CCOC2 34a_100000705350_100000690089 [0,1,1,0,0,0|1,0,0]=3 812 B16R2.135 Cc1ccc(cc1)CCNC2CCSC2 270004a_100000705350_100000212027 [0,1,1,0,0,0|1,0,0]=3 813 B16R2.135 Cc1ccc(cc1)CCN[C@@H]2CCOC2 2230a_200015188469_100011713686 [0,1,1,0,0,0|1,0,0]=3 814 B16R2.135 Cc1ccc(cc1)CCN[C@H]2CCOC2 2230a_100015188467_100011713686 [0,1,1,0,0,0|1,0,0]=3 815 B16R2.135 Cc1ccc(cc1)CCN[C@H]2CCOC2 34a_100015188467_100011713686 [0,1,1,0,0,0|1,0,0]=3 816 B16R2.135 Cc1ccc(cc1)CCOC2CCCC2 34a_100000210269_100011713686 [0,1,1,0,0,0|1,0,0]=3 817 B16R2.135 Cc1ccc(cc1)CCOC2CCCC2 34a_100000756670_100000179811 [0,1,1,0,0,0|1,0,0]=3 818 B16R2.135 Cc1ccc(cc1)CCOC2CCCC2 7a_100000210269_100011713686 [0,1,1,0,0,0|1,0,0]=3 819 B16R2.135 Cc1ccc(cc1)CCOC2CCCC2 7a_100000756670_100000179811 [0,1,1,0,0,0|1,0,0]=3 820 B16R2.135 Cc1ccc(cc1)CCOC2CCCO2 34a_100000085407_100011713686 [0,1,1,0,0,0|2,0,0]=4 821 B16R2.135 Cc1ccc(cc1)CCOC2CCOC2 34a_100000756670_100000690089 [0,1,1,0,0,0|2,0,0]=4 822 B16R2.135 Cc1ccc(cc1)CCOC2CCOC2 7a_100000756670_100000731011 [0,1,1,0,0,0|2,0,0]=4 823 B16R2.135 Cc1ccc(cc1)CCOC2CCSC2 7a_100011232664_100011713686 [0,1,1,0,0,0|2,0,0]=4 824 B16R2.135 Cc1ccc(cc1)CCO[C@H]2CCOC2 34a_100000717292_100011713686 [0,1,1,0,0,0|2,0,0]=4 825 B16R2.135 Cc1ccc(cc1)CCSC2CCCC2 62a_100011217020_100011713686 [0,1,1,0,0,0|1,0,0]=3 826 B16R2.135 Cc1ccc(cc1)CCSC2CCCC2 62a_100011713686_100000179811 [0,1,1,0,0,0|1,0,0]=3 827 B16R2.135 Cc1ccc(cc1)CCSC2CCOC2 62a_100011713686_100000690089 [0,1,1,0,0,0|2,0,0]=4 828 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 207a_100000737975_100000211033 [0,1,1,0,0,0|2,0,0]=4 829 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 2230a_100000174908_100000740388 [0,1,1,0,0,0|2,0,0]=4 830 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 2230a_100000737975_100000210814 [0,1,1,0,0,0|2,0,0]=4 831 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 269862a_100000174908_100000746403 [0,1,1,0,0,0|2,0,0]=4 832 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 270004a_100000737975_100000211033 [0,1,1,0,0,0|2,0,0]=4 833 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 34a_100000174908_100000740388 [0,1,1,0,0,0|2,0,0]=4 834 B16R2.135 Cc1ccc(cc1)CNCC2CCCC2 34a_100000737975_100000210814 [0,1,1,0,0,0|2,0,0]=4 835 B16R2.135 Cc1ccc(cc1)COCC2CCCC2 34a_100000742336_100000210814 [0,1,1,0,0,0|2,0,0]=4 836 B16R2.135 Cc1ccc(cc1)COCC2CCCC2 34a_100011215236_100000740388 [0,1,1,0,0,0|2,0,0]=4 837 B16R2.135 Cc1ccc(cc1)COCC2CCCC2 7a_100000742336_100000210814 [0,1,1,0,0,0|2,0,0]=4 838 B16R2.135 Cc1ccc(cc1)COCC2CCCC2 7a_100011215236_100000740388 [0,1,1,0,0,0|2,0,0]=4 839 B16R2.135 Cc1ccc(cc1)CSCC2CCCC2 62a_100000210814_100000740388 [0,1,1,0,0,0|2,0,0]=4 840 B16R2.135 Cc1ccc(cc1)CSCC2CCCC2 62a_100000740388_100000210814 [0,1,1,0,0,0|2,0,0]=4 841 B16R2.135 Cc1ccc(cc1)NCCC2CCCC2 34a_100000124888_100000760354 [0,1,1,0,0,0|2,0,0]=4 842 B16R2.135 Cc1ccc(cc1)OCCC2CCCC2 34a_100000210336_100000760354 [0,1,1,0,0,0|2,0,0]=4 843 B16R2.135 Cc1ccc(cc1)OCCC2CCCC2 7a_100000210336_100000760354 [0,1,1,0,0,0|2,0,0]=4 844 B16R2.135 Cc1ccc(cc1)SCCC2CCCC2 62a_100000186775_100000760354 [0,1,1,0,0,0|2,0,0]=4 845 B16R2.135 Cc1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000186775 [0,1,1,0,0,0|2,0,0]=4 846 B16R2.135 Cc1ccc(cn1)CCOC2CCCC2 34a_100011815783_100000179811 [0,1,1,0,0,0|2,0,0]=4 847 B16R2.135 Clc1ccc(cc1)C=NNC2CCCC2 4a_100000737850_100000189385 [0,1,1,0,0,0|1,0,1]=4 848 B16R2.135 Clc1ccc(cc1)CCCN2CCCC2 2230a_100000188435_100000759440 [0,1,1,0,0,0|2,0,0]=4 849 B16R2.135 Clc1ccc(cc1)CCCN2CCCC2 269982a_100000188435_100000759440 [0,1,1,0,0,0|2,0,0]=4 850 B16R2.135 Clc1ccc(cc1)CCNC2CC=CC2 2230a_100015188752_100011713675 [0,1,1,0,0,0|0,0,2]=4 851 B16R2.135 Clc1ccc(cc1)CCNC2CCCC2 2230a_100000185265_100000179811 [0,1,1,0,0,0|0,0,0]=2 852 B16R2.135 Clc1ccc(cc1)CCNC2CCCC2 2230a_100000211070_100011713675 [0,1,1,0,0,0|0,0,0]=2 853 B16R2.135 Clc1ccc(cc1)CCNC2CCCC2 270004a_100000185265_100000210133 [0,1,1,0,0,0|0,0,0]=2 854 B16R2.135 Clc1ccc(cc1)CCNC2CCCC2 34a_100000185265_100000179811 [0,1,1,0,0,0|0,0,0]=2 855 B16R2.135 Clc1ccc(cc1)CCNC2CCCC2 34a_100000211070_100011713675 [0,1,1,0,0,0|0,0,0]=2 856 B16R2.135 Clc1ccc(cc1)CCNC2CCOC2 2230a_100000185265_100000731011 [0,1,1,0,0,0|1,0,0]=3 857 B16R2.135 Clc1ccc(cc1)CCNC2CCOC2 270004a_100000185265_100000752484 [0,1,1,0,0,0|1,0,0]=3 858 B16R2.135 Clc1ccc(cc1)CCNC2CCOC2 34a_100000185265_100000690089 [0,1,1,0,0,0|1,0,0]=3 859 B16R2.135 Clc1ccc(cc1)CCNC2CCSC2 270004a_100000185265_100000212027 [0,1,1,0,0,0|1,0,0]=3 860 B16R2.135 Clc1ccc(cc1)CCN[C@@H]2CCOC2 2230a_200015188469_100011713675 [0,1,1,0,0,0|1,0,0]=3 861 B16R2.135 Clc1ccc(cc1)CCN[C@H]2CCOC2 2230a_100015188467_100011713675 [0,1,1,0,0,0|1,0,0]=3 862 B16R2.135 Clc1ccc(cc1)CCN[C@H]2CCOC2 34a_100015188467_100011713675 [0,1,1,0,0,0|1,0,0]=3 863 B16R2.135 Clc1ccc(cc1)CCOC2CCCC2 34a_100000210269_100011713675 [0,1,1,0,0,0|1,0,0]=3 864 B16R2.135 Clc1ccc(cc1)CCOC2CCCC2 34a_100011219627_100000179811 [0,1,1,0,0,0|1,0,0]=3 865 B16R2.135 Clc1ccc(cc1)CCOC2CCCC2 7a_100000210269_100011713675 [0,1,1,0,0,0|1,0,0]=3 866 B16R2.135 Clc1ccc(cc1)CCOC2CCCC2 7a_100011219627_100000179811 [0,1,1,0,0,0|1,0,0]=3 867 B16R2.135 Clc1ccc(cc1)CCOC2CCCO2 34a_100000085407_100011713675 [0,1,1,0,0,0|2,0,0]=4 868 B16R2.135 Clc1ccc(cc1)CCOC2CCOC2 34a_100011219627_100000690089 [0,1,1,0,0,0|2,0,0]=4 869 B16R2.135 Clc1ccc(cc1)CCOC2CCOC2 7a_100011219627_100000731011 [0,1,1,0,0,0|2,0,0]=4 870 B16R2.135 Clc1ccc(cc1)CCOC2CCSC2 7a_100011232664_100011713675 [0,1,1,0,0,0|2,0,0]=4 871 B16R2.135 Clc1ccc(cc1)CCO[C@H]2CCOC2 34a_100000717292_100011713675 [0,1,1,0,0,0|2,0,0]=4 872 B16R2.135 Clc1ccc(cc1)CCSC2CCCC2 62a_100011217020_100011713675 [0,1,1,0,0,0|1,0,0]=3 873 B16R2.135 Clc1ccc(cc1)CCSC2CCCC2 62a_100011713675_100000179811 [0,1,1,0,0,0|1,0,0]=3 874 B16R2.135 Clc1ccc(cc1)CCSC2CCOC2 62a_100011713675_100000690089 [0,1,1,0,0,0|2,0,0]=4 875 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 207a_100000737975_100000189385 [0,1,1,0,0,0|2,0,0]=4 876 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 2230a_100000174871_100000740388 [0,1,1,0,0,0|2,0,0]=4 877 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 2230a_100000737975_100000694040 [0,1,1,0,0,0|2,0,0]=4 878 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 269862a_100000174871_100000746403 [0,1,1,0,0,0|2,0,0]=4 879 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 270004a_100000737975_100000189385 [0,1,1,0,0,0|2,0,0]=4 880 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 34a_100000174871_100000740388 [0,1,1,0,0,0|2,0,0]=4 881 B16R2.135 Clc1ccc(cc1)CNCC2CCCC2 34a_100000737975_100000694040 [0,1,1,0,0,0|2,0,0]=4 882 B16R2.135 Clc1ccc(cc1)COCC2CCCC2 34a_100000211118_100000740388 [0,1,1,0,0,0|2,0,0]=4 883 B16R2.135 Clc1ccc(cc1)COCC2CCCC2 34a_100000742336_100000694040 [0,1,1,0,0,0|2,0,0]=4 884 B16R2.135 Clc1ccc(cc1)COCC2CCCC2 7a_100000211118_100000740388 [0,1,1,0,0,0|2,0,0]=4 885 B16R2.135 Clc1ccc(cc1)COCC2CCCC2 7a_100000742336_100000187161 [0,1,1,0,0,0|2,0,0]=4 886 B16R2.135 Clc1ccc(cc1)CSCC2CCCC2 62a_100000187161_100000740388 [0,1,1,0,0,0|2,0,0]=4 887 B16R2.135 Clc1ccc(cc1)CSCC2CCCC2 62a_100000740388_100000187161 [0,1,1,0,0,0|2,0,0]=4 888 B16R2.135 Clc1ccc(cc1)NCCC2CCCC2 2230a_100000210052_100000760354 [0,1,1,0,0,0|2,0,0]=4 889 B16R2.135 Clc1ccc(cc1)NCCC2CCCC2 34a_100000210052_100000760354 [0,1,1,0,0,0|2,0,0]=4 890 B16R2.135 Clc1ccc(cc1)OCCC2CCCC2 34a_100000210216_100000760354 [0,1,1,0,0,0|2,0,0]=4 891 B16R2.135 Clc1ccc(cc1)OCCC2CCCC2 7a_100000210216_100000760354 [0,1,1,0,0,0|2,0,0]=4 892 B16R2.135 Clc1ccc(cc1)SCCC2CCCC2 62a_100000755918_100000760354 [0,1,1,0,0,0|2,0,0]=4 893 B16R2.135 Clc1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000755918 [0,1,1,0,0,0|2,0,0]=4 894 B16R2.135 Clc1ccc(cn1)CCOC2CCCC2 34a_100009880866_100000179811 [0,1,1,0,0,0|2,0,0]=4 895 B16R2.135 Clc1ccc(cn1)CCOC2CCCC2 7a_100009880866_100000179811 [0,1,1,0,0,0|2,0,0]=4 896 B16R2.135 Fc1ccc(cc1)C=NNC2CCCC2 4a_100000737850_100000210084 [0,1,1,0,0,0|1,0,1]=4 897 B16R2.135 Fc1ccc(cc1)CCCN2CCCC2 2230a_100000188435_200011713563 [0,1,1,0,0,0|2,0,0]=4 898 B16R2.135 Fc1ccc(cc1)CCCN2CCCC2 269982a_100000188435_200011713563 [0,1,1,0,0,0|2,0,0]=4 899 B16R2.135 Fc1ccc(cc1)CCNC2CC=CC2 2230a_100015188752_100011217392 [0,1,1,0,0,0|0,0,2]=4 900 B16R2.135 Fc1ccc(cc1)CCNC2CCCC2 2230a_100000199005_100000179811 [0,1,1,0,0,0|0,0,0]=2 901 B16R2.135 Fc1ccc(cc1)CCNC2CCCC2 2230a_100000211070_100011217392 [0,1,1,0,0,0|0,0,0]=2 902 B16R2.135 Fc1ccc(cc1)CCNC2CCCC2 270004a_100000199005_100000210133 [0,1,1,0,0,0|0,0,0]=2 903 B16R2.135 Fc1ccc(cc1)CCNC2CCCC2 34a_100000199005_100000179811 [0,1,1,0,0,0|0,0,0]=2 904 B16R2.135 Fc1ccc(cc1)CCNC2CCCC2 34a_100000211070_100011217392 [0,1,1,0,0,0|0,0,0]=2 905 B16R2.135 Fc1ccc(cc1)CCNC2CCOC2 2230a_100000199005_100000731011 [0,1,1,0,0,0|1,0,0]=3 906 B16R2.135 Fc1ccc(cc1)CCNC2CCOC2 270004a_100000199005_100000752484 [0,1,1,0,0,0|1,0,0]=3 907 B16R2.135 Fc1ccc(cc1)CCNC2CCOC2 34a_100000199005_100000690089 [0,1,1,0,0,0|1,0,0]=3 908 B16R2.135 Fc1ccc(cc1)CCNC2CCSC2 270004a_100000199005_100000212027 [0,1,1,0,0,0|1,0,0]=3 909 B16R2.135 Fc1ccc(cc1)CCN[C@@H]2CCOC2 2230a_200015188469_100011217392 [0,1,1,0,0,0|1,0,0]=3 910 B16R2.135 Fc1ccc(cc1)CCN[C@H]2CCOC2 2230a_100015188467_100011217392 [0,1,1,0,0,0|1,0,0]=3 911 B16R2.135 Fc1ccc(cc1)CCN[C@H]2CCOC2 34a_100015188467_100011217392 [0,1,1,0,0,0|1,0,0]=3 912 B16R2.135 Fc1ccc(cc1)CCOC2CCCC2 34a_100000210269_100011217392 [0,1,1,0,0,0|1,0,0]=3 913 B16R2.135 Fc1ccc(cc1)CCOC2CCCC2 34a_100000754732_100000179811 [0,1,1,0,0,0|1,0,0]=3 914 B16R2.135 Fc1ccc(cc1)CCOC2CCCC2 7a_100000210269_100011217392 [0,1,1,0,0,0|1,0,0]=3 915 B16R2.135 Fc1ccc(cc1)CCOC2CCCC2 7a_100000754732_100000179811 [0,1,1,0,0,0|1,0,0]=3 916 B16R2.135 Fc1ccc(cc1)CCOC2CCCO2 34a_100000085407_100011217392 [0,1,1,0,0,0|2,0,0]=4 917 B16R2.135 Fc1ccc(cc1)CCOC2CCOC2 34a_100000754732_100000690089 [0,1,1,0,0,0|2,0,0]=4 918 B16R2.135 Fc1ccc(cc1)CCOC2CCOC2 7a_100000754732_100000731011 [0,1,1,0,0,0|2,0,0]=4 919 B16R2.135 Fc1ccc(cc1)CCOC2CCSC2 7a_100011232664_100011217392 [0,1,1,0,0,0|2,0,0]=4 920 B16R2.135 Fc1ccc(cc1)CCO[C@H]2CCOC2 34a_100000717292_100011217392 [0,1,1,0,0,0|2,0,0]=4 921 B16R2.135 Fc1ccc(cc1)CCSC2CCCC2 62a_100011217020_100011217392 [0,1,1,0,0,0|1,0,0]=3 922 B16R2.135 Fc1ccc(cc1)CCSC2CCCC2 62a_100011217392_100000179811 [0,1,1,0,0,0|1,0,0]=3 923 B16R2.135 Fc1ccc(cc1)CCSC2CCOC2 62a_100011217392_100000690089 [0,1,1,0,0,0|2,0,0]=4 924 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 207a_100000737975_100000210084 [0,1,1,0,0,0|2,0,0]=4 925 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 2230a_100000174882_100000740388 [0,1,1,0,0,0|2,0,0]=4 926 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 2230a_100000737975_100000198546 [0,1,1,0,0,0|2,0,0]=4 927 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 269862a_100000174882_100000746403 [0,1,1,0,0,0|2,0,0]=4 928 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 270004a_100000737975_100000210084 [0,1,1,0,0,0|2,0,0]=4 929 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 34a_100000174882_100000740388 [0,1,1,0,0,0|2,0,0]=4 930 B16R2.135 Fc1ccc(cc1)CNCC2CCCC2 34a_100000737975_100000198546 [0,1,1,0,0,0|2,0,0]=4 931 B16R2.135 Fc1ccc(cc1)COCC2CCCC2 34a_100000210977_100000740388 [0,1,1,0,0,0|2,0,0]=4 932 B16R2.135 Fc1ccc(cc1)COCC2CCCC2 34a_100000742336_100000198546 [0,1,1,0,0,0|2,0,0]=4 933 B16R2.135 Fc1ccc(cc1)COCC2CCCC2 7a_100000210977_100000740388 [0,1,1,0,0,0|2,0,0]=4 934 B16R2.135 Fc1ccc(cc1)COCC2CCCC2 7a_100000742336_100000198546 [0,1,1,0,0,0|2,0,0]=4 935 B16R2.135 Fc1ccc(cc1)CSCC2CCCC2 62a_100000198546_100000740388 [0,1,1,0,0,0|2,0,0]=4 936 B16R2.135 Fc1ccc(cc1)CSCC2CCCC2 62a_100000740388_100000187164 [0,1,1,0,0,0|2,0,0]=4 937 B16R2.135 Fc1ccc(cc1)NCCC2CCCC2 34a_100000185862_100000760354 [0,1,1,0,0,0|2,0,0]=4 938 B16R2.135 Fc1ccc(cc1)OCCC2CCCC2 34a_100000210339_100000760354 [0,1,1,0,0,0|2,0,0]=4 939 B16R2.135 Fc1ccc(cc1)SCCC2CCCC2 62a_100000211213_100000760354 [0,1,1,0,0,0|2,0,0]=4 940 B16R2.135 Fc1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000211213 [0,1,1,0,0,0|2,0,0]=4 941 B16R2.135 Ic1ccc(cc1)C=NNC2CCCC2 4a_100000737850_100000188517 [0,1,1,0,0,0|1,0,1]=4 942 B16R2.135 Ic1ccc(cc1)CCOC2CCCC2 34a_100012291149_100000179811 [0,1,1,0,0,0|1,0,0]=3 943 B16R2.135 Ic1ccc(cc1)CCOC2CCCC2 7a_100012291149_100000179811 [0,1,1,0,0,0|1,0,0]=3 944 B16R2.135 Ic1ccc(cc1)CCOC2CCOC2 34a_100012291149_100000690089 [0,1,1,0,0,0|2,0,0]=4 945 B16R2.135 Ic1ccc(cc1)CCOC2CCOC2 7a_100012291149_100000731011 [0,1,1,0,0,0|2,0,0]=4 946 B16R2.135 Ic1ccc(cc1)CNCC2CCCC2 207a_100000737975_100000188517 [0,1,1,0,0,0|2,0,0]=4 947 B16R2.135 Ic1ccc(cc1)CNCC2CCCC2 2230a_100000737975_100000189116 [0,1,1,0,0,0|2,0,0]=4 948 B16R2.135 Ic1ccc(cc1)CNCC2CCCC2 2230a_100016989417_100000740388 [0,1,1,0,0,0|2,0,0]=4 949 B16R2.135 Ic1ccc(cc1)CNCC2CCCC2 269862a_100016989417_100000746403 [0,1,1,0,0,0|2,0,0]=4 950 B16R2.135 Ic1ccc(cc1)CNCC2CCCC2 34a_100000737975_100000189116 [0,1,1,0,0,0|2,0,0]=4 951 B16R2.135 Ic1ccc(cc1)CNCC2CCCC2 34a_100016989417_100000740388 [0,1,1,0,0,0|2,0,0]=4 952 B16R2.135 Ic1ccc(cc1)COCC2CCCC2 34a_100000690907_100000740388 [0,1,1,0,0,0|2,0,0]=4 953 B16R2.135 Ic1ccc(cc1)COCC2CCCC2 34a_100000742336_100000189116 [0,1,1,0,0,0|2,0,0]=4 954 B16R2.135 Ic1ccc(cc1)COCC2CCCC2 7a_100000690907_100000740388 [0,1,1,0,0,0|2,0,0]=4 955 B16R2.135 Ic1ccc(cc1)COCC2CCCC2 7a_100000742336_100000189116 [0,1,1,0,0,0|2,0,0]=4 956 B16R2.135 Ic1ccc(cc1)CSCC2CCCC2 62a_100000189116_100000740388 [0,1,1,0,0,0|2,0,0]=4 957 B16R2.135 Ic1ccc(cc1)CSCC2CCCC2 62a_100000740388_100000189116 [0,1,1,0,0,0|2,0,0]=4 958 B16R2.135 Ic1ccc(cc1)NCCC2CCCC2 34a_100000185761_100000760354 [0,1,1,0,0,0|2,0,0]=4 959 B16R2.135 Ic1ccc(cc1)OCCC2CCCC2 34a_100000212066_100000760354 [0,1,1,0,0,0|2,0,0]=4 960 B16R2.135 Ic1ccc(cc1)OCCC2CCCC2 7a_100000212066_100000760354 [0,1,1,0,0,0|2,0,0]=4 961 B16R2.135 Nc1ccc(cc1)CCOC2CCCC2 34a_100011204434_100000179811 [0,1,1,0,0,0|1,0,0]=3 962 B16R2.135 Nc1ccc(cc1)CCOC2CCOC2 34a_100011204434_100000690089 [0,1,1,0,0,0|2,0,0]=4 963 B16R2.135 Nc1ccc(cc1)COCC2CCCC2 34a_100011215238_100000740388 [0,1,1,0,0,0|2,0,0]=4 964 B16R2.135 Nc1ccc(cc1)OCCC2CCCC2 34a_100000185829_100000760354 [0,1,1,0,0,0|2,0,0]=4 965 B16R2.135 Nc1ccc(cc1)SCCC2CCCC2 62a_100000185761_100000760354 [0,1,1,0,0,0|2,0,0]=4 966 B16R2.135 Nc1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000185761 [0,1,1,0,0,0|2,0,0]=4 967 B16R2.135 Oc1ccc(cc1)C=NNC2CCCC2 4a_100000737850_100000185832 [0,1,1,0,0,0|1,0,1]=4 968 B16R2.135 Oc1ccc(cc1)CCNC2CC=CC2 2230a_100015188752_100009816426 [0,1,1,0,0,0|0,0,2]=4 969 B16R2.135 Oc1ccc(cc1)CCNC2CCCC2 2230a_100000211070_100009816426 [0,1,1,0,0,0|0,0,0]=2 970 B16R2.135 Oc1ccc(cc1)CCNC2CCCC2 270004a_100000743037_100000210133 [0,1,1,0,0,0|0,0,0]=2 971 B16R2.135 Oc1ccc(cc1)CCNC2CCCC2 34a_100000743037_100000179811 [0,1,1,0,0,0|0,0,0]=2 972 B16R2.135 Oc1ccc(cc1)CCNC2CCOC2 270004a_100000743037_100000752484 [0,1,1,0,0,0|1,0,0]=3 973 B16R2.135 Oc1ccc(cc1)CCNC2CCOC2 34a_100000743037_100000690089 [0,1,1,0,0,0|1,0,0]=3 974 B16R2.135 Oc1ccc(cc1)CCNC2CCSC2 270004a_100000743037_100000212027 [0,1,1,0,0,0|1,0,0]=3 975 B16R2.135 Oc1ccc(cc1)CCN[C@@H]2CCOC2 2230a_200015188469_100009816426 [0,1,1,0,0,0|1,0,0]=3 976 B16R2.135 Oc1ccc(cc1)CCN[C@H]2CCOC2 2230a_100015188467_100009816426 [0,1,1,0,0,0|1,0,0]=3 977 B16R2.135 Oc1ccc(cc1)CCOC2CCCC2 7a_100000210269_100009816426 [0,1,1,0,0,0|1,0,0]=3 978 B16R2.135 Oc1ccc(cc1)CCOC2CCSC2 7a_100011232664_100009816426 [0,1,1,0,0,0|2,0,0]=4 979 B16R2.135 Oc1ccc(cc1)CCSC2CCCC2 62a_100009816426_100000179811 [0,1,1,0,0,0|1,0,0]=3 980 B16R2.135 Oc1ccc(cc1)CCSC2CCCC2 62a_100011217020_100009816426 [0,1,1,0,0,0|1,0,0]=3 981 B16R2.135 Oc1ccc(cc1)CCSC2CCOC2 62a_100009816426_100000690089 [0,1,1,0,0,0|2,0,0]=4 982 B16R2.135 Oc1ccc(cc1)CNCC2CCCC2 34a_100000185549_100000740388 [0,1,1,0,0,0|2,0,0]=4 983 B16R2.135 Oc1ccc(cc1)NCCC2CCCC2 34a_100000185829_100000760354 [0,1,1,0,0,0|2,0,0]=4 984 B16R2.135 Oc1ccc(cc1)SCCC2CCCC2 62a_100000760354_100000185759 [0,1,1,0,0,0|2,0,0]=4 985 B16R2.255 Brc1cccc(c1)C=NNC2CCCC2 4a_100000737850_100000210085 [0,1,1,0,0,0|1,0,1]=4 986 B16R2.255 Brc1cccc(c1)CCCN2CCCC2 2230a_100000188435_100011713683 [0,1,1,0,0,0|2,0,0]=4 987 B16R2.255 Brc1cccc(c1)CCCN2CCCC2 269982a_100000188435_100011713683 [0,1,1,0,0,0|2,0,0]=4 988 B16R2.255 Brc1cccc(c1)CCNC2CC=CC2 2230a_100015188752_100011740638 [0,1,1,0,0,0|0,0,2]=4 989 B16R2.255 Brc1cccc(c1)CCNC2CCCC2 2230a_100000211070_100011740638 [0,1,1,0,0,0|0,0,0]=2 990 B16R2.255 Brc1cccc(c1)CCNC2CCCC2 2230a_100011207229_100000179811 [0,1,1,0,0,0|0,0,0]=2 991 B16R2.255 Brc1cccc(c1)CCNC2CCCC2 270004a_100011207229_100000210133 [0,1,1,0,0,0|0,0,0]=2 992 B16R2.255 Brc1cccc(c1)CCNC2CCCC2 34a_100000211070_100011740638 [0,1,1,0,0,0|0,0,0]=2 993 B16R2.255 Brc1cccc(c1)CCNC2CCCC2 34a_100011207229_100000179811 [0,1,1,0,0,0|0,0,0]=2 994 B16R2.255 Brc1cccc(c1)CCNC2CCOC2 2230a_100011207229_100000731011 [0,1,1,0,0,0|1,0,0]=3 995 B16R2.255 Brc1cccc(c1)CCNC2CCOC2 270004a_100011207229_100000752484 [0,1,1,0,0,0|1,0,0]=3 996 B16R2.255 Brc1cccc(c1)CCNC2CCOC2 34a_100011207229_100000690089 [0,1,1,0,0,0|1,0,0]=3 997 B16R2.255 Brc1cccc(c1)CCNC2CCSC2 270004a_100011207229_100000212027 [0,1,1,0,0,0|1,0,0]=3 998 B16R2.255 Brc1cccc(c1)CCN[C@@H]2CCOC2 2230a_200015188469_100011740638 [0,1,1,0,0,0|1,0,0]=3 999 B16R2.255 Brc1cccc(c1)CCN[C@H]2CCOC2 2230a_100015188467_100011740638 [0,1,1,0,0,0|1,0,0]=3 1000 B16R2.255 Brc1cccc(c1)CCN[C@H]2CCOC2 34a_100015188467_100011740638 [0,1,1,0,0,0|1,0,0]=3 1001 B16R2.255 Brc1cccc(c1)CCOC2CCCC2 34a_100000210269_100011740638 [0,1,1,0,0,0|1,0,0]=3 1002 B16R2.255 Brc1cccc(c1)CCOC2CCCC2 34a_100011217444_100000179811 [0,1,1,0,0,0|1,0,0]=3 1003 B16R2.255 Brc1cccc(c1)CCOC2CCCC2 7a_100000210269_100011740638 [0,1,1,0,0,0|1,0,0]=3 1004 B16R2.255 Brc1cccc(c1)CCOC2CCCC2 7a_100011217444_100000179811 [0,1,1,0,0,0|1,0,0]=3 1005 B16R2.255 Brc1cccc(c1)CCOC2CCCO2 34a_100000085407_100011740638 [0,1,1,0,0,0|2,0,0]=4 1006 B16R2.255 Brc1cccc(c1)CCOC2CCOC2 34a_100011217444_100000690089 [0,1,1,0,0,0|2,0,0]=4 1007 B16R2.255 Brc1cccc(c1)CCOC2CCOC2 7a_100011217444_100000731011 [0,1,1,0,0,0|2,0,0]=4 1008 B16R2.255 Brc1cccc(c1)CCOC2CCSC2 7a_100011232664_100011740638 [0,1,1,0,0,0|2,0,0]=4 1009 B16R2.255 Brc1cccc(c1)CCO[C@H]2CCOC2 34a_100000717292_100011740638 [0,1,1,0,0,0|2,0,0]=4 1010 B16R2.255 Brc1cccc(c1)CCSC2CCCC2 62a_100011217020_100011740638 [0,1,1,0,0,0|1,0,0]=3 1011 B16R2.255 Brc1cccc(c1)CCSC2CCCC2 62a_100011740638_100000179811 [0,1,1,0,0,0|1,0,0]=3 1012 B16R2.255 Brc1cccc(c1)CCSC2CCOC2 62a_100011740638_100000690089 [0,1,1,0,0,0|2,0,0]=4 1013 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 207a_100000737975_100000210085 [0,1,1,0,0,0|2,0,0]=4 1014 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 2230a_100000174977_100000740388 [0,1,1,0,0,0|2,0,0]=4 1015 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 2230a_100000737975_100000698116 [0,1,1,0,0,0|2,0,0]=4 1016 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 269862a_100000174977_100000746403 [0,1,1,0,0,0|2,0,0]=4 1017 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 270004a_100000737975_100000210085 [0,1,1,0,0,0|2,0,0]=4 1018 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 34a_100000174977_100000740388 [0,1,1,0,0,0|2,0,0]=4 1019 B16R2.255 Brc1cccc(c1)CNCC2CCCC2 34a_100000737975_100000698116 [0,1,1,0,0,0|2,0,0]=4 1020 B16R2.255 Brc1cccc(c1)COCC2CCCC2 34a_100000687537_100000740388 [0,1,1,0,0,0|2,0,0]=4 1021 B16R2.255 Brc1cccc(c1)COCC2CCCC2 34a_100000742336_100000698116 [0,1,1,0,0,0|2,0,0]=4 1022 B16R2.255 Brc1cccc(c1)COCC2CCCC2 7a_100000687537_100000740388 [0,1,1,0,0,0|2,0,0]=4 1023 B16R2.255 Brc1cccc(c1)COCC2CCCC2 7a_100000742336_100000211773 [0,1,1,0,0,0|2,0,0]=4 1024 B16R2.255 Brc1cccc(c1)CSCC2CCCC2 62a_100000211773_100000740388 [0,1,1,0,0,0|2,0,0]=4 1025 B16R2.255 Brc1cccc(c1)CSCC2CCCC2 62a_100000740388_100000211773 [0,1,1,0,0,0|2,0,0]=4 1026 B16R2.255 Brc1cccc(c1)NCCC2CCCC2 34a_100000210019_100000760354 [0,1,1,0,0,0|2,0,0]=4 1027 B16R2.255 Brc1cccc(c1)OCCC2CCCC2 34a_100000210342_100000760354 [0,1,1,0,0,0|2,0,0]=4 1028 B16R2.255 Brc1cccc(c1)OCCC2CCCC2 7a_100000210342_100000760354 [0,1,1,0,0,0|2,0,0]=4 1029 B16R2.255 Brc1cccc(c1)SCCC2CCCC2 62a_100000691529_100000760354 [0,1,1,0,0,0|2,0,0]=4 1030 B16R2.255 Brc1cccc(c1)SCCC2CCCC2 62a_100000760354_100000691529 [0,1,1,0,0,0|2,0,0]=4 1031 B16R2.255 Brc1cccc(n1)CCOC2CCCC2 34a_100010221043_100000179811 [0,1,1,0,0,0|2,0,0]=4 1032 B16R2.255 Brc1cccc(n1)CCOC2CCCC2 7a_100010221043_100000179811 [0,1,1,0,0,0|2,0,0]=4 1033 B16R2.255 Cc1cccc(c1)C=NNC2CCCC2 4a_100000737850_100000211157 [0,1,1,0,0,0|1,0,1]=4 1034 B16R2.255 Cc1cccc(c1)CCNC2CC=CC2 2230a_100015188752_100011713685 [0,1,1,0,0,0|0,0,2]=4 1035 B16R2.255 Cc1cccc(c1)CCNC2CCCC2 2230a_100000211070_100011713685 [0,1,1,0,0,0|0,0,0]=2 1036 B16R2.255 Cc1cccc(c1)CCNC2CCCC2 2230a_100000749837_100000179811 [0,1,1,0,0,0|0,0,0]=2 1037 B16R2.255 Cc1cccc(c1)CCNC2CCCC2 270004a_100000749837_100000210133 [0,1,1,0,0,0|0,0,0]=2 1038 B16R2.255 Cc1cccc(c1)CCNC2CCCC2 34a_100000211070_100011713685 [0,1,1,0,0,0|0,0,0]=2 1039 B16R2.255 Cc1cccc(c1)CCNC2CCCC2 34a_100000749837_100000179811 [0,1,1,0,0,0|0,0,0]=2 1040 B16R2.255 Cc1cccc(c1)CCNC2CCOC2 2230a_100000749837_100000731011 [0,1,1,0,0,0|1,0,0]=3 1041 B16R2.255 Cc1cccc(c1)CCNC2CCOC2 270004a_100000749837_100000752484 [0,1,1,0,0,0|1,0,0]=3 1042 B16R2.255 Cc1cccc(c1)CCNC2CCOC2 34a_100000749837_100000690089 [0,1,1,0,0,0|1,0,0]=3 1043 B16R2.255 Cc1cccc(c1)CCNC2CCSC2 270004a_100000749837_100000212027 [0,1,1,0,0,0|1,0,0]=3 1044 B16R2.255 Cc1cccc(c1)CCN[C@@H]2CCOC2 2230a_200015188469_100011713685 [0,1,1,0,0,0|1,0,0]=3 1045 B16R2.255 Cc1cccc(c1)CCN[C@H]2CCOC2 2230a_100015188467_100011713685 [0,1,1,0,0,0|1,0,0]=3 1046 B16R2.255 Cc1cccc(c1)CCN[C@H]2CCOC2 34a_100015188467_100011713685 [0,1,1,0,0,0|1,0,0]=3 1047 B16R2.255 Cc1cccc(c1)CCOC2CCCC2 34a_100000210269_100011713685 [0,1,1,0,0,0|1,0,0]=3 1048 B16R2.255 Cc1cccc(c1)CCOC2CCCC2 34a_100011217157_100000179811 [0,1,1,0,0,0|1,0,0]=3 1049 B16R2.255 Cc1cccc(c1)CCOC2CCCC2 7a_100000210269_100011713685 [0,1,1,0,0,0|1,0,0]=3 1050 B16R2.255 Cc1cccc(c1)CCOC2CCCC2 7a_100011217157_100000179811 [0,1,1,0,0,0|1,0,0]=3 1051 B16R2.255 Cc1cccc(c1)CCOC2CCCO2 34a_100000085407_100011713685 [0,1,1,0,0,0|2,0,0]=4 1052 B16R2.255 Cc1cccc(c1)CCOC2CCOC2 34a_100011217157_100000690089 [0,1,1,0,0,0|2,0,0]=4 1053 B16R2.255 Cc1cccc(c1)CCOC2CCOC2 7a_100011217157_100000731011 [0,1,1,0,0,0|2,0,0]=4 1054 B16R2.255 Cc1cccc(c1)CCOC2CCSC2 7a_100011232664_100011713685 [0,1,1,0,0,0|2,0,0]=4 1055 B16R2.255 Cc1cccc(c1)CCO[C@H]2CCOC2 34a_100000717292_100011713685 [0,1,1,0,0,0|2,0,0]=4 1056 B16R2.255 Cc1cccc(c1)CCSC2CCCC2 62a_100011217020_100011713685 [0,1,1,0,0,0|1,0,0]=3 1057 B16R2.255 Cc1cccc(c1)CCSC2CCCC2 62a_100011713685_100000179811 [0,1,1,0,0,0|1,0,0]=3 1058 B16R2.255 Cc1cccc(c1)CCSC2CCOC2 62a_100011713685_100000690089 [0,1,1,0,0,0|2,0,0]=4 1059 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 207a_100000737975_100000211157 [0,1,1,0,0,0|2,0,0]=4 1060 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 2230a_100000185548_100000740388 [0,1,1,0,0,0|2,0,0]=4 1061 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 2230a_100000737975_100000211840 [0,1,1,0,0,0|2,0,0]=4 1062 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 269862a_100000185548_100000746403 [0,1,1,0,0,0|2,0,0]=4 1063 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 270004a_100000737975_100000211157 [0,1,1,0,0,0|2,0,0]=4 1064 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 34a_100000185548_100000740388 [0,1,1,0,0,0|2,0,0]=4 1065 B16R2.255 Cc1cccc(c1)CNCC2CCCC2 34a_100000737975_100000211840 [0,1,1,0,0,0|2,0,0]=4 1066 B16R2.255 Cc1cccc(c1)COCC2CCCC2 34a_100000742336_100000211840 [0,1,1,0,0,0|2,0,0]=4 1067 B16R2.255 Cc1cccc(c1)COCC2CCCC2 34a_100011217746_100000740388 [0,1,1,0,0,0|2,0,0]=4 1068 B16R2.255 Cc1cccc(c1)COCC2CCCC2 7a_100000742336_100000211840 [0,1,1,0,0,0|2,0,0]=4 1069 B16R2.255 Cc1cccc(c1)COCC2CCCC2 7a_100011217746_100000740388 [0,1,1,0,0,0|2,0,0]=4 1070 B16R2.255 Cc1cccc(c1)CSCC2CCCC2 62a_100000211840_100000740388 [0,1,1,0,0,0|2,0,0]=4 1071 B16R2.255 Cc1cccc(c1)CSCC2CCCC2 62a_100000740388_100000211840 [0,1,1,0,0,0|2,0,0]=4 1072 B16R2.255 Cc1cccc(c1)NCCC2CCCC2 2230a_100000188690_100000760354 [0,1,1,0,0,0|2,0,0]=4 1073 B16R2.255 Cc1cccc(c1)NCCC2CCCC2 34a_100000188690_100000760354 [0,1,1,0,0,0|2,0,0]=4 1074 B16R2.255 Cc1cccc(c1)OCCC2CCCC2 34a_100000210337_100000760354 [0,1,1,0,0,0|2,0,0]=4 1075 B16R2.255 Cc1cccc(c1)OCCC2CCCC2 7a_100000210337_100000760354 [0,1,1,0,0,0|2,0,0]=4 1076 B16R2.255 Cc1cccc(c1)SCCC2CCCC2 62a_100000760354_100011215228 [0,1,1,0,0,0|2,0,0]=4 1077 B16R2.255 Cc1cccc(c1)SCCC2CCCC2 62a_100011215228_100000760354 [0,1,1,0,0,0|2,0,0]=4 1078 B16R2.255 Cc1cccc(n1)CCNC2CCCC2 2230a_100011824523_100000179811 [0,1,1,0,0,0|1,0,0]=3 1079 B16R2.255 Cc1cccc(n1)CCNC2CCCC2 270004a_100011824523_100000210133 [0,1,1,0,0,0|1,0,0]=3 1080 B16R2.255 Cc1cccc(n1)CCNC2CCCC2 34a_100011824523_100000179811 [0,1,1,0,0,0|1,0,0]=3 1081 B16R2.255 Cc1cccc(n1)CCNC2CCOC2 2230a_100011824523_100000731011 [0,1,1,0,0,0|2,0,0]=4 1082 B16R2.255 Cc1cccc(n1)CCNC2CCOC2 270004a_100011824523_100000752484 [0,1,1,0,0,0|2,0,0]=4 1083 B16R2.255 Cc1cccc(n1)CCNC2CCOC2 34a_100011824523_100000690089 [0,1,1,0,0,0|2,0,0]=4 1084 B16R2.255 Cc1cccc(n1)CCNC2CCSC2 270004a_100011824523_100000212027 [0,1,1,0,0,0|2,0,0]=4 1085 B16R2.255 Clc1cccc(c1)C=NNC2CCCC2 4a_100000737850_100000210801 [0,1,1,0,0,0|1,0,1]=4 1086 B16R2.255 Clc1cccc(c1)CCNC2CC=CC2 2230a_100015188752_100011713710 [0,1,1,0,0,0|0,0,2]=4 1087 B16R2.255 Clc1cccc(c1)CCNC2CCCC2 2230a_100000185263_100000179811 [0,1,1,0,0,0|0,0,0]=2 1088 B16R2.255 Clc1cccc(c1)CCNC2CCCC2 2230a_100000211070_100011713710 [0,1,1,0,0,0|0,0,0]=2 1089 B16R2.255 Clc1cccc(c1)CCNC2CCCC2 270004a_100000185263_100000210133 [0,1,1,0,0,0|0,0,0]=2 1090 B16R2.255 Clc1cccc(c1)CCNC2CCCC2 34a_100000185263_100000179811 [0,1,1,0,0,0|0,0,0]=2 1091 B16R2.255 Clc1cccc(c1)CCNC2CCCC2 34a_100000211070_100011713710 [0,1,1,0,0,0|0,0,0]=2 1092 B16R2.255 Clc1cccc(c1)CCNC2CCOC2 2230a_100000185263_100000731011 [0,1,1,0,0,0|1,0,0]=3 1093 B16R2.255 Clc1cccc(c1)CCNC2CCOC2 270004a_100000185263_100000752484 [0,1,1,0,0,0|1,0,0]=3 1094 B16R2.255 Clc1cccc(c1)CCNC2CCOC2 34a_100000185263_100000690089 [0,1,1,0,0,0|1,0,0]=3 1095 B16R2.255 Clc1cccc(c1)CCNC2CCSC2 270004a_100000185263_100000212027 [0,1,1,0,0,0|1,0,0]=3 1096 B16R2.255 Clc1cccc(c1)CCN[C@@H]2CCOC2 2230a_200015188469_100011713710 [0,1,1,0,0,0|1,0,0]=3 1097 B16R2.255 Clc1cccc(c1)CCN[C@H]2CCOC2 2230a_100015188467_100011713710 [0,1,1,0,0,0|1,0,0]=3 1098 B16R2.255 Clc1cccc(c1)CCN[C@H]2CCOC2 34a_100015188467_100011713710 [0,1,1,0,0,0|1,0,0]=3 1099 B16R2.255 Clc1cccc(c1)CCOC2CCCC2 34a_100000210269_100011713710 [0,1,1,0,0,0|1,0,0]=3 1100 B16R2.255 Clc1cccc(c1)CCOC2CCCC2 34a_100000754733_100000179811 [0,1,1,0,0,0|1,0,0]=3 1101 B16R2.255 Clc1cccc(c1)CCOC2CCCC2 7a_100000210269_100011713710 [0,1,1,0,0,0|1,0,0]=3 1102 B16R2.255 Clc1cccc(c1)CCOC2CCCC2 7a_100000754733_100000179811 [0,1,1,0,0,0|1,0,0]=3 1103 B16R2.255 Clc1cccc(c1)CCOC2CCCO2 34a_100000085407_100011713710 [0,1,1,0,0,0|2,0,0]=4 1104 B16R2.255 Clc1cccc(c1)CCOC2CCOC2 34a_100000754733_100000690089 [0,1,1,0,0,0|2,0,0]=4 1105 B16R2.255 Clc1cccc(c1)CCOC2CCOC2 7a_100000754733_100000731011 [0,1,1,0,0,0|2,0,0]=4 1106 B16R2.255 Clc1cccc(c1)CCOC2CCSC2 7a_100011232664_100011713710 [0,1,1,0,0,0|2,0,0]=4 1107 B16R2.255 Clc1cccc(c1)CCO[C@H]2CCOC2 34a_100000717292_100011713710 [0,1,1,0,0,0|2,0,0]=4 1108 B16R2.255 Clc1cccc(c1)CCSC2CCCC2 62a_100011217020_100011713710 [0,1,1,0,0,0|1,0,0]=3 1109 B16R2.255 Clc1cccc(c1)CCSC2CCCC2 62a_100011713710_100000179811 [0,1,1,0,0,0|1,0,0]=3 1110 B16R2.255 Clc1cccc(c1)CCSC2CCOC2 62a_100011713710_100000690089 [0,1,1,0,0,0|2,0,0]=4 1111 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 207a_100000737975_100000210801 [0,1,1,0,0,0|2,0,0]=4 1112 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 2230a_100000174878_100000740388 [0,1,1,0,0,0|2,0,0]=4 1113 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 2230a_100000737975_100000181238 [0,1,1,0,0,0|2,0,0]=4 1114 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 269862a_100000174878_100000746403 [0,1,1,0,0,0|2,0,0]=4 1115 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 270004a_100000737975_100000210801 [0,1,1,0,0,0|2,0,0]=4 1116 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 34a_100000174878_100000740388 [0,1,1,0,0,0|2,0,0]=4 1117 B16R2.255 Clc1cccc(c1)CNCC2CCCC2 34a_100000737975_100000187163 [0,1,1,0,0,0|2,0,0]=4 1118 B16R2.255 Clc1cccc(c1)COCC2CCCC2 34a_100000241301_100000740388 [0,1,1,0,0,0|2,0,0]=4 1119 B16R2.255 Clc1cccc(c1)COCC2CCCC2 34a_100000742336_100000187163 [0,1,1,0,0,0|2,0,0]=4 1120 B16R2.255 Clc1cccc(c1)COCC2CCCC2 7a_100000241301_100000740388 [0,1,1,0,0,0|2,0,0]=4 1121 B16R2.255 Clc1cccc(c1)COCC2CCCC2 7a_100000742336_100000187163 [0,1,1,0,0,0|2,0,0]=4 1122 B16R2.255 Clc1cccc(c1)CSCC2CCCC2 62a_100000187163_100000740388 [0,1,1,0,0,0|2,0,0]=4 1123 B16R2.255 Clc1cccc(c1)CSCC2CCCC2 62a_100000740388_100000187163 [0,1,1,0,0,0|2,0,0]=4 1124 B16R2.255 Clc1cccc(c1)NCCC2CCCC2 34a_100000185859_100000760354 [0,1,1,0,0,0|2,0,0]=4 1125 B16R2.255 Clc1cccc(c1)OCCC2CCCC2 34a_100000210295_100000760354 [0,1,1,0,0,0|2,0,0]=4 1126 B16R2.255 Clc1cccc(c1)OCCC2CCCC2 7a_100000210295_100000760354 [0,1,1,0,0,0|2,0,0]=4 1127 B16R2.255 Clc1cccc(c1)SCCC2CCCC2 62a_100000699651_100000760354 [0,1,1,0,0,0|2,0,0]=4 1128 B16R2.255 Clc1cccc(c1)SCCC2CCCC2 62a_100000760354_100000699651 [0,1,1,0,0,0|2,0,0]=4 1129 B16R2.255 Fc1cccc(c1)C=NNC2CCCC2 4a_100000737850_100000210812 [0,1,1,0,0,0|1,0,1]=4 1130 B16R2.255 Fc1cccc(c1)CCCN2CCCC2 2230a_100000188435_200000698031 [0,1,1,0,0,0|2,0,0]=4 1131 B16R2.255 Fc1cccc(c1)CCCN2CCCC2 269982a_100000188435_200000698031 [0,1,1,0,0,0|2,0,0]=4 1132 B16R2.255 Fc1cccc(c1)CCNC2CC=CC2 2230a_100015188752_100011217235 [0,1,1,0,0,0|0,0,2]=4 1133 B16R2.255 Fc1cccc(c1)CCNC2CCCC2 2230a_100000205154_100000179811 [0,1,1,0,0,0|0,0,0]=2 1134 B16R2.255 Fc1cccc(c1)CCNC2CCCC2 2230a_100000211070_100011217235 [0,1,1,0,0,0|0,0,0]=2 1135 B16R2.255 Fc1cccc(c1)CCNC2CCCC2 270004a_100000205154_100000210133 [0,1,1,0,0,0|0,0,0]=2 1136 B16R2.255 Fc1cccc(c1)CCNC2CCCC2 34a_100000205154_100000179811 [0,1,1,0,0,0|0,0,0]=2 1137 B16R2.255 Fc1cccc(c1)CCNC2CCCC2 34a_100000211070_100011217235 [0,1,1,0,0,0|0,0,0]=2 1138 B16R2.255 Fc1cccc(c1)CCNC2CCOC2 2230a_100000205154_100000731011 [0,1,1,0,0,0|1,0,0]=3 1139 B16R2.255 Fc1cccc(c1)CCNC2CCOC2 270004a_100000205154_100000752484 [0,1,1,0,0,0|1,0,0]=3 1140 B16R2.255 Fc1cccc(c1)CCNC2CCOC2 34a_100000205154_100000690089 [0,1,1,0,0,0|1,0,0]=3 1141 B16R2.255 Fc1cccc(c1)CCNC2CCSC2 270004a_100000205154_100000212027 [0,1,1,0,0,0|1,0,0]=3 1142 B16R2.255 Fc1cccc(c1)CCN[C@@H]2CCOC2 2230a_200015188469_100011217235 [0,1,1,0,0,0|1,0,0]=3 1143 B16R2.255 Fc1cccc(c1)CCN[C@H]2CCOC2 2230a_100015188467_100011217235 [0,1,1,0,0,0|1,0,0]=3 1144 B16R2.255 Fc1cccc(c1)CCN[C@H]2CCOC2 34a_100015188467_100011217235 [0,1,1,0,0,0|1,0,0]=3 1145 B16R2.255 Fc1cccc(c1)CCOC2CCCC2 34a_100000210269_100011217235 [0,1,1,0,0,0|1,0,0]=3 1146 B16R2.255 Fc1cccc(c1)CCOC2CCCC2 34a_100000763591_100000179811 [0,1,1,0,0,0|1,0,0]=3 1147 B16R2.255 Fc1cccc(c1)CCOC2CCCC2 7a_100000210269_100011217235 [0,1,1,0,0,0|1,0,0]=3 1148 B16R2.255 Fc1cccc(c1)CCOC2CCCC2 7a_100000763591_100000179811 [0,1,1,0,0,0|1,0,0]=3 1149 B16R2.255 Fc1cccc(c1)CCOC2CCCO2 34a_100000085407_100011217235 [0,1,1,0,0,0|2,0,0]=4 1150 B16R2.255 Fc1cccc(c1)CCOC2CCOC2 34a_100000763591_100000690089 [0,1,1,0,0,0|2,0,0]=4 1151 B16R2.255 Fc1cccc(c1)CCOC2CCOC2 7a_100000763591_100000731011 [0,1,1,0,0,0|2,0,0]=4 1152 B16R2.255 Fc1cccc(c1)CCOC2CCSC2 7a_100011232664_100011217235 [0,1,1,0,0,0|2,0,0]=4 1153 B16R2.255 Fc1cccc(c1)CCO[C@H]2CCOC2 34a_100000717292_100011217235 [0,1,1,0,0,0|2,0,0]=4 1154 B16R2.255 Fc1cccc(c1)CCSC2CCCC2 62a_100011217020_100011217235 [0,1,1,0,0,0|1,0,0]=3 1155 B16R2.255 Fc1cccc(c1)CCSC2CCCC2 62a_100011217235_100000179811 [0,1,1,0,0,0|1,0,0]=3 1156 B16R2.255 Fc1cccc(c1)CCSC2CCOC2 62a_100011217235_100000690089 [0,1,1,0,0,0|2,0,0]=4 1157 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 207a_100000737975_100000210812 [0,1,1,0,0,0|2,0,0]=4 1158 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 2230a_100000174948_100000740388 [0,1,1,0,0,0|2,0,0]=4 1159 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 2230a_100000737975_100000230114 [0,1,1,0,0,0|2,0,0]=4 1160 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 269862a_100000174948_100000746403 [0,1,1,0,0,0|2,0,0]=4 1161 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 270004a_100000737975_100000210812 [0,1,1,0,0,0|2,0,0]=4 1162 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 34a_100000174948_100000740388 [0,1,1,0,0,0|2,0,0]=4 1163 B16R2.255 Fc1cccc(c1)CNCC2CCCC2 34a_100000737975_100000187166 [0,1,1,0,0,0|2,0,0]=4 1164 B16R2.255 Fc1cccc(c1)COCC2CCCC2 34a_100000210976_100000740388 [0,1,1,0,0,0|2,0,0]=4 1165 B16R2.255 Fc1cccc(c1)COCC2CCCC2 34a_100000742336_100000187166 [0,1,1,0,0,0|2,0,0]=4 1166 B16R2.255 Fc1cccc(c1)COCC2CCCC2 7a_100000210976_100000740388 [0,1,1,0,0,0|2,0,0]=4 1167 B16R2.255 Fc1cccc(c1)COCC2CCCC2 7a_100000742336_100000230114 [0,1,1,0,0,0|2,0,0]=4 1168 B16R2.255 Fc1cccc(c1)CSCC2CCCC2 62a_100000230114_100000740388 [0,1,1,0,0,0|2,0,0]=4 1169 B16R2.255 Fc1cccc(c1)CSCC2CCCC2 62a_100000740388_100000230114 [0,1,1,0,0,0|2,0,0]=4 1170 B16R2.255 Fc1cccc(c1)NCCC2CCCC2 34a_100000210047_100000760354 [0,1,1,0,0,0|2,0,0]=4 1171 B16R2.255 Fc1cccc(c1)OCCC2CCCC2 34a_100000210426_100000760354 [0,1,1,0,0,0|2,0,0]=4 1172 B16R2.255 Fc1cccc(c1)OCCC2CCCC2 7a_100000210426_100000760354 [0,1,1,0,0,0|2,0,0]=4 1173 B16R2.255 Fc1cccc(c1)SCCC2CCCC2 62a_100000685547_100000760354 [0,1,1,0,0,0|2,0,0]=4 1174 B16R2.255 Fc1cccc(c1)SCCC2CCCC2 62a_100000760354_100000685547 [0,1,1,0,0,0|2,0,0]=4 1175 B16R2.255 Ic1cccc(c1)C=NNC2CCCC2 4a_100000737850_100000014684 [0,1,1,0,0,0|1,0,1]=4 1176 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 207a_100000737975_100000014684 [0,1,1,0,0,0|2,0,0]=4 1177 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 2230a_100000106179_100000740388 [0,1,1,0,0,0|2,0,0]=4 1178 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 2230a_100000737975_100011218688 [0,1,1,0,0,0|2,0,0]=4 1179 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 269862a_100000106179_100000746403 [0,1,1,0,0,0|2,0,0]=4 1180 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 270004a_100000737975_100000014684 [0,1,1,0,0,0|2,0,0]=4 1181 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 34a_100000106179_100000740388 [0,1,1,0,0,0|2,0,0]=4 1182 B16R2.255 Ic1cccc(c1)CNCC2CCCC2 34a_100000737975_100011218688 [0,1,1,0,0,0|2,0,0]=4 1183 B16R2.255 Ic1cccc(c1)COCC2CCCC2 34a_100000742336_100011218688 [0,1,1,0,0,0|2,0,0]=4 1184 B16R2.255 Ic1cccc(c1)COCC2CCCC2 34a_100011215336_100000740388 [0,1,1,0,0,0|2,0,0]=4 1185 B16R2.255 Ic1cccc(c1)COCC2CCCC2 7a_100000742336_100011218688 [0,1,1,0,0,0|2,0,0]=4 1186 B16R2.255 Ic1cccc(c1)COCC2CCCC2 7a_100011215336_100000740388 [0,1,1,0,0,0|2,0,0]=4 1187 B16R2.255 Ic1cccc(c1)CSCC2CCCC2 62a_100000740388_100011218688 [0,1,1,0,0,0|2,0,0]=4 1188 B16R2.255 Ic1cccc(c1)CSCC2CCCC2 62a_100011218688_100000740388 [0,1,1,0,0,0|2,0,0]=4 1189 B16R2.255 Ic1cccc(c1)NCCC2CCCC2 34a_100000211102_100000760354 [0,1,1,0,0,0|2,0,0]=4 1190 B16R2.255 Ic1cccc(c1)OCCC2CCCC2 34a_100000211634_100000760354 [0,1,1,0,0,0|2,0,0]=4 1191 B16R2.255 Ic1cccc(c1)OCCC2CCCC2 7a_100000211634_100000760354 [0,1,1,0,0,0|2,0,0]=4 1192 B16R2.255 Nc1cccc(c1)CCOC2CCCC2 34a_100011996697_100000179811 [0,1,1,0,0,0|1,0,0]=3 1193 B16R2.255 Nc1cccc(c1)CCOC2CCOC2 34a_100011996697_100000690089 [0,1,1,0,0,0|2,0,0]=4 1194 B16R2.255 Nc1cccc(c1)COCC2CCCC2 34a_100000211919_100000740388 [0,1,1,0,0,0|2,0,0]=4 1195 B16R2.255 Nc1cccc(c1)OCCC2CCCC2 34a_100000210217_100000760354 [0,1,1,0,0,0|2,0,0]=4 1196 B16R2.255 Nc1cccc(c1)SCCC2CCCC2 62a_100000210019_100000760354 [0,1,1,0,0,0|2,0,0]=4 1197 B16R2.255 Nc1cccc(c1)SCCC2CCCC2 62a_100000760354_100000210019 [0,1,1,0,0,0|2,0,0]=4 1198 B16R2.255 Oc1cccc(c1)C=NNC2CCCC2 4a_100000737850_100000188321 [0,1,1,0,0,0|1,0,1]=4 1199 B16R2.255 Oc1cccc(c1)CCNC2CCCC2 2230a_100000747277_100000179811 [0,1,1,0,0,0|0,0,0]=2 1200 B16R2.255 Oc1cccc(c1)CCNC2CCCC2 34a_100000747277_100000179811 [0,1,1,0,0,0|0,0,0]=2 1201 B16R2.255 Oc1cccc(c1)CCNC2CCOC2 2230a_100000747277_100000731011 [0,1,1,0,0,0|1,0,0]=3 1202 B16R2.255 Oc1cccc(c1)CCNC2CCOC2 34a_100000747277_100000690089 [0,1,1,0,0,0|1,0,0]=3 1203 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 207a_100000737975_100000188321 [0,1,1,0,0,0|2,0,0]=4 1204 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 2230a_100000737975_100011660834 [0,1,1,0,0,0|2,0,0]=4 1205 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 2230a_100000743036_100000740388 [0,1,1,0,0,0|2,0,0]=4 1206 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 269862a_100000743036_100000746403 [0,1,1,0,0,0|2,0,0]=4 1207 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 270004a_100000737975_100000188321 [0,1,1,0,0,0|2,0,0]=4 1208 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 34a_100000737975_100011660834 [0,1,1,0,0,0|2,0,0]=4 1209 B16R2.255 Oc1cccc(c1)CNCC2CCCC2 34a_100000743036_100000740388 [0,1,1,0,0,0|2,0,0]=4 1210 B16R2.255 Oc1cccc(c1)COCC2CCCC2 34a_100000742336_100011660834 [0,1,1,0,0,0|2,0,0]=4 1211 B16R2.255 Oc1cccc(c1)COCC2CCCC2 7a_100000742336_100000084143 [0,1,1,0,0,0|2,0,0]=4 1212 B16R2.255 Oc1cccc(c1)CSCC2CCCC2 62a_100000740388_100011660834 [0,1,1,0,0,0|2,0,0]=4 1213 B16R2.255 Oc1cccc(c1)CSCC2CCCC2 62a_100011660834_100000740388 [0,1,1,0,0,0|2,0,0]=4 1214 B16R2.255 Oc1cccc(c1)NCCC2CCCC2 34a_100000210217_100000760354 [0,1,1,0,0,0|2,0,0]=4 1215 B16R2.255 Oc1cccc(c1)SCCC2CCCC2 62a_100000760354_100000211634 [0,1,1,0,0,0|2,0,0]=4 1216 B16R2.255 [S]c1cccc(c1)SCCC2CCCC2 62a_100000760354_114929384022 [0,1,1,0,0,0|2,0,0]=4 1217 B16R2.255 [S]c1cccc(c1)SCCC2CCCC2 62a_114929384022_100000760354 [0,1,1,0,0,0|2,0,0]=4 1218 B16R2.524 CC(C[n+]1ccccc1)NC2CCCC2 270004a_100000211070_100000034229 [0,1,1,0,0,0|1,0,0]=3 1219 B16R2.524 CC(C[n+]1ccccc1)N[C@@H]2CCOC2 270004a_200015188469_100000034229 [0,1,1,0,0,0|2,0,0]=4 1220 B16R2.524 CC(C[n+]1ccccc1)N[C@H]2CCOC2 270004a_100015188467_100000034229 [0,1,1,0,0,0|2,0,0]=4 1221 B16R2.524 CC(Cc1ccccc1)NC2CCCC2 34a_100000211070_200011218536 [0,1,1,0,0,0|0,0,0]=2 1222 B16R2.524 CC(Cc1ccccc1)N[C@H]2CCOC2 34a_100015188467_200011218536 [0,1,1,0,0,0|1,0,0]=3 1223 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 34a_100000210269_200011218536 [0,1,1,0,0,0|1,0,0]=3 1224 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 34a_100000748627_100000179811 [0,1,1,0,0,0|1,0,0]=3 1225 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 7a_100000210269_200011218536 [0,1,1,0,0,0|1,0,0]=3 1226 B16R2.524 CC(Cc1ccccc1)OC2CCCC2 7a_100000748627_100000179811 [0,1,1,0,0,0|1,0,0]=3 1227 B16R2.524 CC(Cc1ccccc1)OC2CCCO2 34a_100000085407_200011218536 [0,1,1,0,0,0|2,0,0]=4 1228 B16R2.524 CC(Cc1ccccc1)OC2CCOC2 34a_100000748627_100000690089 [0,1,1,0,0,0|2,0,0]=4 1229 B16R2.524 CC(Cc1ccccc1)OC2CCOC2 7a_100000748627_100000731011 [0,1,1,0,0,0|2,0,0]=4 1230 B16R2.524 CC(Cc1ccccc1)OC2CCSC2 7a_100011232664_200011218536 [0,1,1,0,0,0|2,0,0]=4 1231 B16R2.524 CC(Cc1ccccc1)O[C@H]2CCOC2 34a_100000717292_200011218536 [0,1,1,0,0,0|2,0,0]=4 1232 B16R2.524 CC(Cc1ccccc1)SC2CCCC2 62a_100011217020_200011218536 [0,1,1,0,0,0|1,0,0]=3 1233 B16R2.524 CC(Cc1ccccc1)SC2CCCC2 62a_200011218536_100000179811 [0,1,1,0,0,0|1,0,0]=3 1234 B16R2.524 CC(Cc1ccccc1)SC2CCOC2 62a_200011218536_100000690089 [0,1,1,0,0,0|2,0,0]=4 1235 B16R2.524 CC(Cc1ccccn1)NC2CCCC2 2230a_100000238496_100000179811 [0,1,1,0,0,0|1,0,0]=3 1236 B16R2.524 CC(Cc1ccccn1)NC2CCCC2 270004a_100000238496_100000210133 [0,1,1,0,0,0|1,0,0]=3 1237 B16R2.524 CC(Cc1ccccn1)NC2CCOC2 2230a_100000238496_100000731011 [0,1,1,0,0,0|2,0,0]=4 1238 B16R2.524 CC(Cc1ccccn1)NC2CCOC2 270004a_100000238496_100000752484 [0,1,1,0,0,0|2,0,0]=4 1239 B16R2.524 CC(Cc1ccccn1)NC2CCSC2 270004a_100000238496_100000212027 [0,1,1,0,0,0|2,0,0]=4 1240 B16R2.524 CC(Cc1cccnc1)NC2CCCC2 2230a_100011207255_100000179811 [0,1,1,0,0,0|1,0,0]=3 1241 B16R2.524 CC(Cc1cccnc1)NC2CCCC2 270004a_100000211070_100015187140 [0,1,1,0,0,0|1,0,0]=3 1242 B16R2.524 CC(Cc1cccnc1)NC2CCCC2 270004a_100011207255_100000210133 [0,1,1,0,0,0|1,0,0]=3 1243 B16R2.524 CC(Cc1cccnc1)NC2CCOC2 2230a_100011207255_100000731011 [0,1,1,0,0,0|2,0,0]=4 1244 B16R2.524 CC(Cc1cccnc1)NC2CCOC2 270004a_100011207255_100000752484 [0,1,1,0,0,0|2,0,0]=4 1245 B16R2.524 CC(Cc1cccnc1)NC2CCSC2 270004a_100011207255_100000212027 [0,1,1,0,0,0|2,0,0]=4 1246 B16R2.524 CC(Cc1cccnc1)N[C@@H]2CCOC2 270004a_200015188469_100015187140 [0,1,1,0,0,0|2,0,0]=4 1247 B16R2.524 CC(Cc1cccnc1)N[C@H]2CCOC2 270004a_100015188467_100015187140 [0,1,1,0,0,0|2,0,0]=4 1248 B16R2.524 CC(Cc1ccncc1)NC2CCCC2 270004a_100000211070_100000238508 [0,1,1,0,0,0|1,0,0]=3 1249 B16R2.524 CC(Cc1ccncc1)N[C@@H]2CCOC2 270004a_200015188469_100000238508 [0,1,1,0,0,0|2,0,0]=4 1250 B16R2.524 CC(Cc1ccncc1)N[C@H]2CCOC2 270004a_100015188467_100000238508 [0,1,1,0,0,0|2,0,0]=4 1251 B16R2.524 CC(Cc1cnccn1)NC2CCCC2 2230a_100011277835_100000179811 [0,1,1,0,0,0|2,0,0]=4 1252 B16R2.524 CC(Cc1cnccn1)NC2CCCC2 270004a_100000211070_100015184882 [0,1,1,0,0,0|2,0,0]=4 1253 B16R2.524 CC(Cc1cnccn1)NC2CCCC2 270004a_100011277835_100000210133 [0,1,1,0,0,0|2,0,0]=4 1254 B16R2.524 CN(Cc1ccccc1)CC2CCCC2 2230a_100000186898_100000740388 [0,1,1,0,0,0|2,0,0]=4 1255 B16R2.524 CN(Cc1ccccc1)CC2CCCC2 269982a_100000186898_100000740388 [0,1,1,0,0,0|2,0,0]=4 1256 B16R2.524 O=C(C[n+]1ccccc1)NC2CCCC2 11a_100000211070_200000086051 [0,1,1,0,0,0|1,0,1]=4 1257 B16R2.524 O=C(C[n+]1ccccc1)NC2CCCC2 240690a_100000211070_200000086051 [0,1,1,0,0,0|1,0,1]=4 1258 B16R2.524 O=C(C[n+]1ccccc1)NC2CCCC2 527a_100000211070_200000086051 [0,1,1,0,0,0|1,0,1]=4 1259 B16R2.524 O=C(Cc1ccccc1)CC2CCCC2 1458a_100000210891_100015291786 [0,1,1,0,0,0|1,0,1]=4 1260 B16R2.524 O=C(Cc1ccccn1)NC2CCCC2 11a_100000211070_100000233486 [0,1,1,0,0,0|1,0,1]=4 1261 B16R2.524 O=C(Cc1cccnc1)NC2CCCC2 11a_100000211070_100000737805 [0,1,1,0,0,0|1,0,1]=4 1262 B16R2.524 O=C(Cc1cccnc1)NC2CCCC2 240690a_100000211070_100000737805 [0,1,1,0,0,0|1,0,1]=4 1263 B16R2.524 O=C(Cc1cccnc1)NC2CCCC2 527a_100000211070_100000737805 [0,1,1,0,0,0|1,0,1]=4 1264 B16R2.524 O=C(Cc1ccncc1)NC2CCCC2 11a_100000211070_100011201483 [0,1,1,0,0,0|1,0,1]=4 1265 B16R2.524 O=C(Cc1ccncc1)NC2CCCC2 240690a_100000211070_100011201483 [0,1,1,0,0,0|1,0,1]=4 1266 B16R2.524 O=C(Nc1ccccc1)NC2CCCC2 2430a_100000106764_100000211070 [0,1,1,0,0,0|1,0,1]=4 1267 B16R2.524 O[C@@H](Cc1ccccc1)CN2CCCC2 2230a_100000188435_100000729385 [0,1,1,0,0,0|2,0,0]=4 1268 B16R2.524 O[C@@H](Cc1ccccc1)CN2CCCC2 269982a_100000188435_100000729385 [0,1,1,0,0,0|2,0,0]=4 1269 B16R2.2238 CC(CCc1ccccc1)N2CCCC2 270004a_100000188435_100000210092 [0,1,1,0,0,0|2,0,0]=4 1270 B16R2.2238 CC(NCc1ccccc1)C2CCCC2 207a_100015185923_100015611070 [0,1,1,0,0,0|2,0,0]=4 1271 B16R2.2238 CC(NCc1ccccc1)C2CCCC2 2230a_100015185923_100015291786 [0,1,1,0,0,0|2,0,0]=4 1272 B16R2.2238 CC(NCc1ccccc1)C2CCCC2 269862a_100015324214_100000749594 [0,1,1,0,0,0|2,0,0]=4 1273 B16R2.2238 CC(NCc1ccccc1)C2CCCC2 270004a_100015185923_100015611070 [0,1,1,0,0,0|2,0,0]=4 1274 B16R2.2238 CC(NCc1ccccc1)C2CCCC2 270004a_100015324214_100000749594 [0,1,1,0,0,0|2,0,0]=4 1275 B16R2.2238 CC(NCc1ccccc1)C2CCCC2 34a_100015185923_100015291786 [0,1,1,0,0,0|2,0,0]=4 1276 B16R2.2238 CC(OCc1ccccc1)C2CCCC2 34a_100011216366_100015291786 [0,1,1,0,0,0|2,0,0]=4 1277 B16R2.2238 CC(OCc1ccccc1)C2CCCC2 7a_100011216366_100000211182 [0,1,1,0,0,0|2,0,0]=4 1278 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 2230a_100000200390_200000210301 [0,1,1,0,0,0|0,0,0]=2 1279 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 2230a_100000207497_100000179811 [0,1,1,0,0,0|0,0,0]=2 1280 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 2230a_100000207505_100000765856 [0,1,1,0,0,0|0,0,0]=2 1281 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 269982a_100000200390_200000210301 [0,1,1,0,0,0|0,0,0]=2 1282 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 269982a_100000207497_100000179811 [0,1,1,0,0,0|0,0,0]=2 1283 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 269982a_100000207505_100000765856 [0,1,1,0,0,0|0,0,0]=2 1284 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 270004a_100000207497_100000210133 [0,1,1,0,0,0|0,0,0]=2 1285 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 34a_100000200390_200000210301 [0,1,1,0,0,0|0,0,0]=2 1286 B16R2.2238 CN(CCc1ccccc1)C2CCCC2 34a_100000207505_100000765856 [0,1,1,0,0,0|0,0,0]=2 1287 B16R2.2238 CN(CCc1ccccc1)C2CCOC2 2230a_100000207497_100000731011 [0,1,1,0,0,0|1,0,0]=3 1288 B16R2.2238 CN(CCc1ccccc1)C2CCOC2 2230a_100016988252_100000765856 [0,1,1,0,0,0|1,0,0]=3 1289 B16R2.2238 CN(CCc1ccccc1)C2CCOC2 269982a_100000207497_100000731011 [0,1,1,0,0,0|1,0,0]=3 1290 B16R2.2238 CN(CCc1ccccc1)C2CCOC2 269982a_100016988252_100000765856 [0,1,1,0,0,0|1,0,0]=3 1291 B16R2.2238 CN(CCc1ccccc1)C2CCOC2 270004a_100000207497_100000752484 [0,1,1,0,0,0|1,0,0]=3 1292 B16R2.2238 CN(CCc1ccccc1)C2CCOC2 34a_100016988252_100000765856 [0,1,1,0,0,0|1,0,0]=3 1293 B16R2.2238 CN(CCc1ccccc1)C2CCSC2 270004a_100000207497_100000212027 [0,1,1,0,0,0|1,0,0]=3 1294 B16R2.2238 CN(CCc1ccccn1)C2CCCC2 2230a_100000207505_100015183660 [0,1,1,0,0,0|1,0,0]=3 1295 B16R2.2238 CN(CCc1ccccn1)C2CCCC2 2230a_100000737206_100000179811 [0,1,1,0,0,0|1,0,0]=3 1296 B16R2.2238 CN(CCc1ccccn1)C2CCCC2 269982a_100000207505_100015183660 [0,1,1,0,0,0|1,0,0]=3 1297 B16R2.2238 CN(CCc1ccccn1)C2CCCC2 269982a_100000737206_100000179811 [0,1,1,0,0,0|1,0,0]=3 1298 B16R2.2238 CN(CCc1ccccn1)C2CCCC2 270004a_100000737206_100000210133 [0,1,1,0,0,0|1,0,0]=3 1299 B16R2.2238 CN(CCc1ccccn1)C2CCOC2 2230a_100000737206_100000731011 [0,1,1,0,0,0|2,0,0]=4 1300 B16R2.2238 CN(CCc1ccccn1)C2CCOC2 2230a_100016988252_100015183660 [0,1,1,0,0,0|2,0,0]=4 1301 B16R2.2238 CN(CCc1ccccn1)C2CCOC2 269982a_100000737206_100000731011 [0,1,1,0,0,0|2,0,0]=4 1302 B16R2.2238 CN(CCc1ccccn1)C2CCOC2 269982a_100016988252_100015183660 [0,1,1,0,0,0|2,0,0]=4 1303 B16R2.2238 CN(CCc1ccccn1)C2CCOC2 270004a_100000737206_100000752484 [0,1,1,0,0,0|2,0,0]=4 1304 B16R2.2238 CN(CCc1ccccn1)C2CCSC2 270004a_100000737206_100000212027 [0,1,1,0,0,0|2,0,0]=4 1305 B16R2.2238 CN(CCc1cccnc1)C2CCCC2 2230a_100000207505_200011713674 [0,1,1,0,0,0|1,0,0]=3 1306 B16R2.2238 CN(CCc1cccnc1)C2CCCC2 2230a_100000763209_100000179811 [0,1,1,0,0,0|1,0,0]=3 1307 B16R2.2238 CN(CCc1cccnc1)C2CCCC2 269982a_100000207505_200011713674 [0,1,1,0,0,0|1,0,0]=3 1308 B16R2.2238 CN(CCc1cccnc1)C2CCCC2 269982a_100000763209_100000179811 [0,1,1,0,0,0|1,0,0]=3 1309 B16R2.2238 CN(CCc1cccnc1)C2CCCC2 270004a_100000763209_100000210133 [0,1,1,0,0,0|1,0,0]=3 1310 B16R2.2238 CN(CCc1cccnc1)C2CCOC2 2230a_100000763209_100000731011 [0,1,1,0,0,0|2,0,0]=4 1311 B16R2.2238 CN(CCc1cccnc1)C2CCOC2 2230a_100016988252_200011713674 [0,1,1,0,0,0|2,0,0]=4 1312 B16R2.2238 CN(CCc1cccnc1)C2CCOC2 269982a_100000763209_100000731011 [0,1,1,0,0,0|2,0,0]=4 1313 B16R2.2238 CN(CCc1cccnc1)C2CCOC2 269982a_100016988252_200011713674 [0,1,1,0,0,0|2,0,0]=4 1314 B16R2.2238 CN(CCc1cccnc1)C2CCOC2 270004a_100000763209_100000752484 [0,1,1,0,0,0|2,0,0]=4 1315 B16R2.2238 CN(CCc1cccnc1)C2CCSC2 270004a_100000763209_100000212027 [0,1,1,0,0,0|2,0,0]=4 1316 B16R2.2238 CN(CCc1ccncc1)C2CCCC2 2230a_100000207505_100000723409 [0,1,1,0,0,0|1,0,0]=3 1317 B16R2.2238 CN(CCc1ccncc1)C2CCCC2 2230a_100000742850_100000179811 [0,1,1,0,0,0|1,0,0]=3 1318 B16R2.2238 CN(CCc1ccncc1)C2CCCC2 269982a_100000207505_100000723409 [0,1,1,0,0,0|1,0,0]=3 1319 B16R2.2238 CN(CCc1ccncc1)C2CCCC2 269982a_100000742850_100000179811 [0,1,1,0,0,0|1,0,0]=3 1320 B16R2.2238 CN(CCc1ccncc1)C2CCCC2 270004a_100000742850_100000210133 [0,1,1,0,0,0|1,0,0]=3 1321 B16R2.2238 CN(CCc1ccncc1)C2CCOC2 2230a_100000742850_100000731011 [0,1,1,0,0,0|2,0,0]=4 1322 B16R2.2238 CN(CCc1ccncc1)C2CCOC2 2230a_100016988252_100000723409 [0,1,1,0,0,0|2,0,0]=4 1323 B16R2.2238 CN(CCc1ccncc1)C2CCOC2 269982a_100000742850_100000731011 [0,1,1,0,0,0|2,0,0]=4 1324 B16R2.2238 CN(CCc1ccncc1)C2CCOC2 269982a_100016988252_100000723409 [0,1,1,0,0,0|2,0,0]=4 1325 B16R2.2238 CN(CCc1ccncc1)C2CCOC2 270004a_100000742850_100000752484 [0,1,1,0,0,0|2,0,0]=4 1326 B16R2.2238 CN(CCc1ccncc1)C2CCSC2 270004a_100000742850_100000212027 [0,1,1,0,0,0|2,0,0]=4 1327 B16R2.2238 CN(CSc1ccccc1)C2CCCC2 2230a_100000207505_100011218342 [0,1,1,0,0,0|1,0,0]=3 1328 B16R2.2238 CN(CSc1ccccc1)C2CCCC2 269982a_100000207505_100011218342 [0,1,1,0,0,0|1,0,0]=3 1329 B16R2.2238 CN(CSc1ccccc1)C2CCOC2 2230a_100016988252_100011218342 [0,1,1,0,0,0|2,0,0]=4 1330 B16R2.2238 CN(CSc1ccccc1)C2CCOC2 269982a_100016988252_100011218342 [0,1,1,0,0,0|2,0,0]=4 1331 B16R2.2238 O=C(CCc1ccccc1)C2CCCC2 1458a_100000185753_100000179811 [0,1,1,0,0,0|1,0,0]=3 1332 B16R2.2238 O=C(CCc1ccccc1)C2CCCC2 1458a_100000210718_100000765856 [0,1,1,0,0,0|1,0,0]=3 1333 B16R2.2238 O=C(CCc1ccccc1)C2CCCS2 1458a_100012002731_100000765856 [0,1,1,0,0,0|2,0,0]=4 1334 B16R2.2238 O=C(CCc1ccccc1)C2CCOC2 1458a_100000185753_100000690089 [0,1,1,0,0,0|2,0,0]=4 1335 B16R2.2238 O=C(CCc1ccccc1)C2CCOC2 1458a_100011219752_100000765856 [0,1,1,0,0,0|2,0,0]=4 1336 B16R2.2238 O=C(CCc1ccccc1)N2CCCC2 240690a_100000188435_100000185753 [0,1,1,0,0,0|2,0,0]=4 1337 B16R2.2238 O=C(CCc1ccccc1)N2CCCC2 527a_100000188435_100000185753 [0,1,1,0,0,0|2,0,0]=4 1338 B16R2.2238 O=C(CCc1ccccc1)[C@@H]2CCCO2 1458a_100000686382_100000765856 [0,1,1,0,0,0|2,0,0]=4 1339 B16R2.2238 O=C(CCc1ccccn1)C2CCCC2 1458a_100000210718_100015183660 [0,1,1,0,0,0|2,0,0]=4 1340 B16R2.2238 O=C(CCc1ccccn1)C2CCCC2 1458a_100015195070_100000179811 [0,1,1,0,0,0|2,0,0]=4 1341 B16R2.2238 O=C(CCc1cccnc1)C2CCCC2 1458a_100000198484_100000179811 [0,1,1,0,0,0|2,0,0]=4 1342 B16R2.2238 O=C(CCc1cccnc1)C2CCCC2 1458a_100000210718_200011713674 [0,1,1,0,0,0|2,0,0]=4 1343 B16R2.2238 O=C(CCc1ccncc1)C2CCCC2 1458a_100000210718_100000723409 [0,1,1,0,0,0|2,0,0]=4 1344 B16R2.2238 O=C(CCc1ccncc1)C2CCCC2 1458a_100011225043_100000179811 [0,1,1,0,0,0|2,0,0]=4 1345 B16R2.2238 O=C(COc1ccccc1)C2CCCC2 1458a_100000186222_100000179811 [0,1,1,0,0,0|2,0,0]=4 1346 B16R2.2238 O=C(CSc1ccccc1)C2CCCC2 1458a_100000211596_100000179811 [0,1,1,0,0,0|2,0,0]=4 1347 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 11a_100015324214_100000210718 [0,1,1,0,0,0|2,0,0]=4 1348 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 1626a_100015324214_100000210718 [0,1,1,0,0,0|2,0,0]=4 1349 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 240690a_100015324214_100000210718 [0,1,1,0,0,0|2,0,0]=4 1350 B16R2.2238 O=C(NCc1ccccc1)C2CCCC2 527a_100015324214_100000210718 [0,1,1,0,0,0|2,0,0]=4 1351 B16R2.2238 [13CH3]N(CCc1ccccc1)C2CCCC2 2230a_100000200390_200025704644 [0,1,1,0,0,0|0,0,0]=2 1352 B16R2.2238 [13CH3]N(CCc1ccccc1)C2CCCC2 269982a_100000200390_200025704644 [0,1,1,0,0,0|0,0,0]=2 1353 B16R2.2238 [13CH3]N(CCc1ccccc1)C2CCCC2 34a_100000200390_200025704644 [0,1,1,0,0,0|0,0,0]=2 1354 B16R2.2832 CC1CCC(C1)NCCc2ccccc2 270004a_100000106460_100011215218 [0,1,1,0,0,0|0,0,0]=2 1355 B16R2.2832 CC1CCC(C1)NCCc2ccccn2 270004a_100000211156_100011215218 [0,1,1,0,0,0|1,0,0]=3 1356 B16R2.2832 CC1CCC(C1)NCCc2cccnc2 270004a_100000736294_100011215218 [0,1,1,0,0,0|1,0,0]=3 1357 B16R2.2832 CC1CCC(C1)NCCc2ccncc2 270004a_100000742849_100011215218 [0,1,1,0,0,0|1,0,0]=3 1358 B16R2.2832 CC1CCC(C1)NCCc2cnccn2 270004a_100000723456_100011215218 [0,1,1,0,0,0|2,0,0]=4 1359 B16R2.2832 CC1CCC(C1)OCCc2ccccc2 34a_100000698185_100000765856 [0,1,1,0,0,0|1,0,0]=3 1360 B16R2.2832 CN1CCC(C1)OCCc2ccccc2 7a_100000210268_200012183744 [0,1,1,0,0,0|2,0,0]=4 1361 B16R2.2832 CN1CCC(C1)SCCc2ccccc2 62a_100000765856_200012183744 [0,1,1,0,0,0|2,0,0]=4 1362 B16R2.2832 C[C@@H]1CCN(C1)CCCc2ccccc2 2230a_100016987628_100000211621 [0,1,1,0,0,0|2,0,0]=4 1363 B16R2.2832 C[C@@H]1CCN(C1)CCCc2ccccc2 269982a_100016987628_100000211621 [0,1,1,0,0,0|2,0,0]=4 1364 B16R2.2832 C[C@@H]1CCN(C1)CCCc2ccccc2 34a_100016987628_100000211621 [0,1,1,0,0,0|2,0,0]=4 1365 B16R2.2832 F[C@H]1CCN(C1)CCCc2ccccc2 2230a_100015203821_100000211621 [0,1,1,0,0,0|2,0,0]=4 1366 B16R2.2832 F[C@H]1CCN(C1)CCCc2ccccc2 269982a_100015203821_100000211621 [0,1,1,0,0,0|2,0,0]=4 1367 B16R2.2832 F[C@H]1CCN(C1)CCCc2ccccc2 34a_100015203821_100000211621 [0,1,1,0,0,0|2,0,0]=4 1368 B16R2.2832 O=C1CC(CN1)NCCc2ccccc2 2230a_100000697751_100000765856 [0,1,1,0,0,0|1,0,1]=4 1369 B16R2.2832 O=C1CCC(C1)OCCc2ccccc2 34a_100012614533_100000765856 [0,1,1,0,0,0|1,0,1]=4 1370 B16R2.2832 OC1CCC(C1)NCCc2ccccc2 270004a_100000106460_100012614533 [0,1,1,0,0,0|0,0,0]=2 1371 B16R2.2832 OC1CCC(C1)NCCc2ccccn2 270004a_100000211156_100012614533 [0,1,1,0,0,0|1,0,0]=3 1372 B16R2.2832 OC1CCC(C1)NCCc2cccnc2 270004a_100000736294_100012614533 [0,1,1,0,0,0|1,0,0]=3 1373 B16R2.2832 OC1CCC(C1)NCCc2ccncc2 270004a_100000742849_100012614533 [0,1,1,0,0,0|1,0,0]=3 1374 B16R2.2832 OC1CCC(C1)NCCc2cnccn2 270004a_100000723456_100012614533 [0,1,1,0,0,0|2,0,0]=4 1375 B16R2.2832 OC1CCN(C1)CCCc2ccccc2 2230a_100011215560_100000211621 [0,1,1,0,0,0|2,0,0]=4 1376 B16R2.2832 OC1CCN(C1)CCCc2ccccc2 269982a_100011215560_100000211621 [0,1,1,0,0,0|2,0,0]=4 1377 B16R2.2832 O[C@@H]1CC[C@@H](C1)NCCc2ccccc2 2230a_100015195300_100000765856 [0,1,1,0,0,0|0,0,0]=2 1378 B16R2.2832 O[C@@H]1CC[C@@H](C1)NCCc2ccccn2 2230a_100015195300_100015183660 [0,1,1,0,0,0|1,0,0]=3 1379 B16R2.2832 O[C@@H]1CC[C@@H](C1)NCCc2cccnc2 2230a_100015195300_200011713674 [0,1,1,0,0,0|1,0,0]=3 1380 B16R2.2832 O[C@@H]1CC[C@@H](C1)NCCc2ccncc2 2230a_100015195300_100000723409 [0,1,1,0,0,0|1,0,0]=3 1381 B16R2.2832 O[C@@H]1CC[C@@H](C1)NCSc2ccccc2 2230a_100015195300_100011218342 [0,1,1,0,0,0|1,0,0]=3 1382 B16R2.2959 Brc1ccccc1C=NNC2CCCC2 4a_100000737850_100000211189 [0,1,1,0,0,0|1,0,1]=4 1383 B16R2.2959 Brc1ccccc1CCCN2CCCC2 2230a_100000188435_200011713681 [0,1,1,0,0,0|2,0,0]=4 1384 B16R2.2959 Brc1ccccc1CCCN2CCCC2 269982a_100000188435_200011713681 [0,1,1,0,0,0|2,0,0]=4 1385 B16R2.2959 Brc1ccccc1CCNC2CC=CC2 2230a_100015188752_100012161201 [0,1,1,0,0,0|0,0,2]=4 1386 B16R2.2959 Brc1ccccc1CCNC2CCCC2 2230a_100000211070_100012161201 [0,1,1,0,0,0|0,0,0]=2 1387 B16R2.2959 Brc1ccccc1CCNC2CCCC2 2230a_100000747383_100000179811 [0,1,1,0,0,0|0,0,0]=2 1388 B16R2.2959 Brc1ccccc1CCNC2CCCC2 270004a_100000747383_100000210133 [0,1,1,0,0,0|0,0,0]=2 1389 B16R2.2959 Brc1ccccc1CCNC2CCCC2 34a_100000211070_100012161201 [0,1,1,0,0,0|0,0,0]=2 1390 B16R2.2959 Brc1ccccc1CCNC2CCCC2 34a_100000747383_100000179811 [0,1,1,0,0,0|0,0,0]=2 1391 B16R2.2959 Brc1ccccc1CCNC2CCOC2 2230a_100000747383_100000731011 [0,1,1,0,0,0|1,0,0]=3 1392 B16R2.2959 Brc1ccccc1CCNC2CCOC2 270004a_100000747383_100000752484 [0,1,1,0,0,0|1,0,0]=3 1393 B16R2.2959 Brc1ccccc1CCNC2CCOC2 34a_100000747383_100000690089 [0,1,1,0,0,0|1,0,0]=3 1394 B16R2.2959 Brc1ccccc1CCNC2CCSC2 270004a_100000747383_100000212027 [0,1,1,0,0,0|1,0,0]=3 1395 B16R2.2959 Brc1ccccc1CCN[C@@H]2CCOC2 2230a_200015188469_100012161201 [0,1,1,0,0,0|1,0,0]=3 1396 B16R2.2959 Brc1ccccc1CCN[C@H]2CCOC2 2230a_100015188467_100012161201 [0,1,1,0,0,0|1,0,0]=3 1397 B16R2.2959 Brc1ccccc1CCN[C@H]2CCOC2 34a_100015188467_100012161201 [0,1,1,0,0,0|1,0,0]=3 1398 B16R2.2959 Brc1ccccc1CCOC2CCCC2 34a_100000210269_100012161201 [0,1,1,0,0,0|1,0,0]=3 1399 B16R2.2959 Brc1ccccc1CCOC2CCCC2 34a_100000731337_100000179811 [0,1,1,0,0,0|1,0,0]=3 1400 B16R2.2959 Brc1ccccc1CCOC2CCCC2 7a_100000210269_100012161201 [0,1,1,0,0,0|1,0,0]=3 1401 B16R2.2959 Brc1ccccc1CCOC2CCCC2 7a_100000731337_100000179811 [0,1,1,0,0,0|1,0,0]=3 1402 B16R2.2959 Brc1ccccc1CCOC2CCCO2 34a_100000085407_100012161201 [0,1,1,0,0,0|2,0,0]=4 1403 B16R2.2959 Brc1ccccc1CCOC2CCOC2 34a_100000731337_100000690089 [0,1,1,0,0,0|2,0,0]=4 1404 B16R2.2959 Brc1ccccc1CCOC2CCOC2 7a_100000731337_100000731011 [0,1,1,0,0,0|2,0,0]=4 1405 B16R2.2959 Brc1ccccc1CCOC2CCSC2 7a_100011232664_100012161201 [0,1,1,0,0,0|2,0,0]=4 1406 B16R2.2959 Brc1ccccc1CCO[C@H]2CCOC2 34a_100000717292_100012161201 [0,1,1,0,0,0|2,0,0]=4 1407 B16R2.2959 Brc1ccccc1CCSC2CCCC2 62a_100011217020_100012161201 [0,1,1,0,0,0|1,0,0]=3 1408 B16R2.2959 Brc1ccccc1CCSC2CCCC2 62a_100012161201_100000179811 [0,1,1,0,0,0|1,0,0]=3 1409 B16R2.2959 Brc1ccccc1CCSC2CCOC2 62a_100012161201_100000690089 [0,1,1,0,0,0|2,0,0]=4 1410 B16R2.2959 Brc1ccccc1CNCC2CCCC2 207a_100000737975_100000211189 [0,1,1,0,0,0|2,0,0]=4 1411 B16R2.2959 Brc1ccccc1CNCC2CCCC2 2230a_100000689332_100000740388 [0,1,1,0,0,0|2,0,0]=4 1412 B16R2.2959 Brc1ccccc1CNCC2CCCC2 2230a_100000737975_100000184730 [0,1,1,0,0,0|2,0,0]=4 1413 B16R2.2959 Brc1ccccc1CNCC2CCCC2 269862a_100000689332_100000746403 [0,1,1,0,0,0|2,0,0]=4 1414 B16R2.2959 Brc1ccccc1CNCC2CCCC2 270004a_100000737975_100000211189 [0,1,1,0,0,0|2,0,0]=4 1415 B16R2.2959 Brc1ccccc1CNCC2CCCC2 34a_100000689332_100000740388 [0,1,1,0,0,0|2,0,0]=4 1416 B16R2.2959 Brc1ccccc1CNCC2CCCC2 34a_100000737975_100000184730 [0,1,1,0,0,0|2,0,0]=4 1417 B16R2.2959 Brc1ccccc1COCC2CCCC2 34a_100000742336_100000184730 [0,1,1,0,0,0|2,0,0]=4 1418 B16R2.2959 Brc1ccccc1COCC2CCCC2 34a_100000756307_100000740388 [0,1,1,0,0,0|2,0,0]=4 1419 B16R2.2959 Brc1ccccc1COCC2CCCC2 7a_100000742336_100000184730 [0,1,1,0,0,0|2,0,0]=4 1420 B16R2.2959 Brc1ccccc1COCC2CCCC2 7a_100000756307_100000740388 [0,1,1,0,0,0|2,0,0]=4 1421 B16R2.2959 Brc1ccccc1CSCC2CCCC2 62a_100000184730_100000740388 [0,1,1,0,0,0|2,0,0]=4 1422 B16R2.2959 Brc1ccccc1CSCC2CCCC2 62a_100000740388_100000184730 [0,1,1,0,0,0|2,0,0]=4 1423 B16R2.2959 Brc1ccccc1NCCC2CCCC2 34a_100000210017_100000760354 [0,1,1,0,0,0|2,0,0]=4 1424 B16R2.2959 Brc1ccccc1OCCC2CCCC2 34a_100000181306_100000760354 [0,1,1,0,0,0|2,0,0]=4 1425 B16R2.2959 Brc1ccccc1OCCC2CCCC2 7a_100000181306_100000760354 [0,1,1,0,0,0|2,0,0]=4 1426 B16R2.2959 Brc1ccccc1SCCC2CCCC2 62a_100000695589_100000760354 [0,1,1,0,0,0|2,0,0]=4 1427 B16R2.2959 Brc1ccccc1SCCC2CCCC2 62a_100000760354_100000695589 [0,1,1,0,0,0|2,0,0]=4 1428 B16R2.2959 Cc1ccccc1C=NNC2CCCC2 4a_100000737850_100000211143 [0,1,1,0,0,0|1,0,1]=4 1429 B16R2.2959 Cc1ccccc1CCNC2CC=CC2 2230a_100015188752_100011713688 [0,1,1,0,0,0|0,0,2]=4 1430 B16R2.2959 Cc1ccccc1CCNC2CCCC2 2230a_100000211070_100011713688 [0,1,1,0,0,0|0,0,0]=2 1431 B16R2.2959 Cc1ccccc1CCNC2CCCC2 2230a_100000685071_100000179811 [0,1,1,0,0,0|0,0,0]=2 1432 B16R2.2959 Cc1ccccc1CCNC2CCCC2 270004a_100000685071_100000210133 [0,1,1,0,0,0|0,0,0]=2 1433 B16R2.2959 Cc1ccccc1CCNC2CCCC2 34a_100000211070_100011713688 [0,1,1,0,0,0|0,0,0]=2 1434 B16R2.2959 Cc1ccccc1CCNC2CCCC2 34a_100000685071_100000179811 [0,1,1,0,0,0|0,0,0]=2 1435 B16R2.2959 Cc1ccccc1CCNC2CCOC2 2230a_100000685071_100000731011 [0,1,1,0,0,0|1,0,0]=3 1436 B16R2.2959 Cc1ccccc1CCNC2CCOC2 270004a_100000685071_100000752484 [0,1,1,0,0,0|1,0,0]=3 1437 B16R2.2959 Cc1ccccc1CCNC2CCOC2 34a_100000685071_100000690089 [0,1,1,0,0,0|1,0,0]=3 1438 B16R2.2959 Cc1ccccc1CCNC2CCSC2 270004a_100000685071_100000212027 [0,1,1,0,0,0|1,0,0]=3 1439 B16R2.2959 Cc1ccccc1CCN[C@@H]2CCOC2 2230a_200015188469_100011713688 [0,1,1,0,0,0|1,0,0]=3 1440 B16R2.2959 Cc1ccccc1CCN[C@H]2CCOC2 2230a_100015188467_100011713688 [0,1,1,0,0,0|1,0,0]=3 1441 B16R2.2959 Cc1ccccc1CCN[C@H]2CCOC2 34a_100015188467_100011713688 [0,1,1,0,0,0|1,0,0]=3 1442 B16R2.2959 Cc1ccccc1CCOC2CCCC2 34a_100000210269_100011713688 [0,1,1,0,0,0|1,0,0]=3 1443 B16R2.2959 Cc1ccccc1CCOC2CCCC2 34a_100011220023_100000179811 [0,1,1,0,0,0|1,0,0]=3 1444 B16R2.2959 Cc1ccccc1CCOC2CCCC2 7a_100000210269_100011713688 [0,1,1,0,0,0|1,0,0]=3 1445 B16R2.2959 Cc1ccccc1CCOC2CCCC2 7a_100011220023_100000179811 [0,1,1,0,0,0|1,0,0]=3 1446 B16R2.2959 Cc1ccccc1CCOC2CCCO2 34a_100000085407_100011713688 [0,1,1,0,0,0|2,0,0]=4 1447 B16R2.2959 Cc1ccccc1CCOC2CCOC2 34a_100011220023_100000690089 [0,1,1,0,0,0|2,0,0]=4 1448 B16R2.2959 Cc1ccccc1CCOC2CCOC2 7a_100011220023_100000731011 [0,1,1,0,0,0|2,0,0]=4 1449 B16R2.2959 Cc1ccccc1CCOC2CCSC2 7a_100011232664_100011713688 [0,1,1,0,0,0|2,0,0]=4 1450 B16R2.2959 Cc1ccccc1CCO[C@H]2CCOC2 34a_100000717292_100011713688 [0,1,1,0,0,0|2,0,0]=4 1451 B16R2.2959 Cc1ccccc1CCSC2CCCC2 62a_100011217020_100011713688 [0,1,1,0,0,0|1,0,0]=3 1452 B16R2.2959 Cc1ccccc1CCSC2CCCC2 62a_100011713688_100000179811 [0,1,1,0,0,0|1,0,0]=3 1453 B16R2.2959 Cc1ccccc1CCSC2CCOC2 62a_100011713688_100000690089 [0,1,1,0,0,0|2,0,0]=4 1454 B16R2.2959 Cc1ccccc1CNCC2CCCC2 207a_100000737975_100000211143 [0,1,1,0,0,0|2,0,0]=4 1455 B16R2.2959 Cc1ccccc1CNCC2CCCC2 2230a_100000737975_100000211839 [0,1,1,0,0,0|2,0,0]=4 1456 B16R2.2959 Cc1ccccc1CNCC2CCCC2 269862a_100000174972_100000746403 [0,1,1,0,0,0|2,0,0]=4 1457 B16R2.2959 Cc1ccccc1CNCC2CCCC2 270004a_100000737975_100000211143 [0,1,1,0,0,0|2,0,0]=4 1458 B16R2.2959 Cc1ccccc1CNCC2CCCC2 34a_100000174972_100000740388 [0,1,1,0,0,0|2,0,0]=4 1459 B16R2.2959 Cc1ccccc1CNCC2CCCC2 34a_100000737975_100000211839 [0,1,1,0,0,0|2,0,0]=4 1460 B16R2.2959 Cc1ccccc1COCC2CCCC2 34a_100000698903_100000740388 [0,1,1,0,0,0|2,0,0]=4 1461 B16R2.2959 Cc1ccccc1COCC2CCCC2 34a_100000742336_100000211839 [0,1,1,0,0,0|2,0,0]=4 1462 B16R2.2959 Cc1ccccc1COCC2CCCC2 7a_100000698903_100000740388 [0,1,1,0,0,0|2,0,0]=4 1463 B16R2.2959 Cc1ccccc1COCC2CCCC2 7a_100000742336_100000211839 [0,1,1,0,0,0|2,0,0]=4 1464 B16R2.2959 Cc1ccccc1CSCC2CCCC2 62a_100000211839_100000740388 [0,1,1,0,0,0|2,0,0]=4 1465 B16R2.2959 Cc1ccccc1CSCC2CCCC2 62a_100000740388_100000211839 [0,1,1,0,0,0|2,0,0]=4 1466 B16R2.2959 Cc1ccccc1NCCC2CCCC2 34a_100015192222_100000760354 [0,1,1,0,0,0|2,0,0]=4 1467 B16R2.2959 Cc1ccccc1OCCC2CCCC2 34a_100000210338_100000760354 [0,1,1,0,0,0|2,0,0]=4 1468 B16R2.2959 Cc1ccccc1OCCC2CCCC2 7a_100000210338_100000760354 [0,1,1,0,0,0|2,0,0]=4 1469 B16R2.2959 Cc1ccccc1SCCC2CCCC2 62a_100000210755_100000760354 [0,1,1,0,0,0|2,0,0]=4 1470 B16R2.2959 Cc1ccccc1SCCC2CCCC2 62a_100000760354_100000210755 [0,1,1,0,0,0|2,0,0]=4 1471 B16R2.2959 Cc1cccnc1CCOC2CCCC2 34a_100011997706_100000179811 [0,1,1,0,0,0|2,0,0]=4 1472 B16R2.2959 Cc1cccnc1CCOC2CCCC2 7a_100011997706_100000179811 [0,1,1,0,0,0|2,0,0]=4 1473 B16R2.2959 Clc1ccccc1C=NNC2CCCC2 4a_100000737850_100000210073 [0,1,1,0,0,0|1,0,1]=4 1474 B16R2.2959 Clc1ccccc1CCNC2CC=CC2 2230a_100015188752_100011713703 [0,1,1,0,0,0|0,0,2]=4 1475 B16R2.2959 Clc1ccccc1CCNC2CC=CC2 270004a_100015188752_200011713468 [0,1,1,0,0,0|0,0,2]=4 1476 B16R2.2959 Clc1ccccc1CCNC2CCCC2 2230a_100000211070_100011713703 [0,1,1,0,0,0|0,0,0]=2 1477 B16R2.2959 Clc1ccccc1CCNC2CCCC2 2230a_100011207228_100000179811 [0,1,1,0,0,0|0,0,0]=2 1478 B16R2.2959 Clc1ccccc1CCNC2CCCC2 270004a_100000211070_200011713468 [0,1,1,0,0,0|0,0,0]=2 1479 B16R2.2959 Clc1ccccc1CCNC2CCCC2 270004a_100011207228_100000210133 [0,1,1,0,0,0|0,0,0]=2 1480 B16R2.2959 Clc1ccccc1CCNC2CCCC2 34a_100000211070_100011713703 [0,1,1,0,0,0|0,0,0]=2 1481 B16R2.2959 Clc1ccccc1CCNC2CCCC2 34a_100011207228_100000179811 [0,1,1,0,0,0|0,0,0]=2 1482 B16R2.2959 Clc1ccccc1CCNC2CCOC2 2230a_100011207228_100000731011 [0,1,1,0,0,0|1,0,0]=3 1483 B16R2.2959 Clc1ccccc1CCNC2CCOC2 270004a_100011207228_100000752484 [0,1,1,0,0,0|1,0,0]=3 1484 B16R2.2959 Clc1ccccc1CCNC2CCOC2 34a_100011207228_100000690089 [0,1,1,0,0,0|1,0,0]=3 1485 B16R2.2959 Clc1ccccc1CCNC2CCSC2 270004a_100011207228_100000212027 [0,1,1,0,0,0|1,0,0]=3 1486 B16R2.2959 Clc1ccccc1CCN[C@@H]2CCOC2 2230a_200015188469_100011713703 [0,1,1,0,0,0|1,0,0]=3 1487 B16R2.2959 Clc1ccccc1CCN[C@@H]2CCOC2 270004a_200015188469_200011713468 [0,1,1,0,0,0|1,0,0]=3 1488 B16R2.2959 Clc1ccccc1CCN[C@H]2CCOC2 2230a_100015188467_100011713703 [0,1,1,0,0,0|1,0,0]=3 1489 B16R2.2959 Clc1ccccc1CCN[C@H]2CCOC2 270004a_100015188467_200011713468 [0,1,1,0,0,0|1,0,0]=3 1490 B16R2.2959 Clc1ccccc1CCN[C@H]2CCOC2 34a_100015188467_100011713703 [0,1,1,0,0,0|1,0,0]=3 1491 B16R2.2959 Clc1ccccc1CCOC2CCCC2 34a_100000210269_100011713703 [0,1,1,0,0,0|1,0,0]=3 1492 B16R2.2959 Clc1ccccc1CCOC2CCCC2 34a_100011215284_100000179811 [0,1,1,0,0,0|1,0,0]=3 1493 B16R2.2959 Clc1ccccc1CCOC2CCCC2 7a_100000210269_100011713703 [0,1,1,0,0,0|1,0,0]=3 1494 B16R2.2959 Clc1ccccc1CCOC2CCCC2 7a_100011215284_100000179811 [0,1,1,0,0,0|1,0,0]=3 1495 B16R2.2959 Clc1ccccc1CCOC2CCCO2 34a_100000085407_100011713703 [0,1,1,0,0,0|2,0,0]=4 1496 B16R2.2959 Clc1ccccc1CCOC2CCOC2 34a_100011215284_100000690089 [0,1,1,0,0,0|2,0,0]=4 1497 B16R2.2959 Clc1ccccc1CCOC2CCOC2 7a_100011215284_100000731011 [0,1,1,0,0,0|2,0,0]=4 1498 B16R2.2959 Clc1ccccc1CCOC2CCSC2 7a_100011232664_100011713703 [0,1,1,0,0,0|2,0,0]=4 1499 B16R2.2959 Clc1ccccc1CCO[C@H]2CCOC2 34a_100000717292_100011713703 [0,1,1,0,0,0|2,0,0]=4 1500 B16R2.2959 Clc1ccccc1CCSC2CCCC2 62a_100011217020_100011713703 [0,1,1,0,0,0|1,0,0]=3 1501 B16R2.2959 Clc1ccccc1CCSC2CCCC2 62a_100011713703_100000179811 [0,1,1,0,0,0|1,0,0]=3 1502 B16R2.2959 Clc1ccccc1CCSC2CCOC2 62a_100011713703_100000690089 [0,1,1,0,0,0|2,0,0]=4 1503 B16R2.2959 Clc1ccccc1CNCC2CCCC2 207a_100000737975_100000210073 [0,1,1,0,0,0|2,0,0]=4 1504 B16R2.2959 Clc1ccccc1CNCC2CCCC2 2230a_100000174879_100000740388 [0,1,1,0,0,0|2,0,0]=4 1505 B16R2.2959 Clc1ccccc1CNCC2CCCC2 2230a_100000737975_100000187162 [0,1,1,0,0,0|2,0,0]=4 1506 B16R2.2959 Clc1ccccc1CNCC2CCCC2 269862a_100000174879_100000746403 [0,1,1,0,0,0|2,0,0]=4 1507 B16R2.2959 Clc1ccccc1CNCC2CCCC2 270004a_100000737975_100000210073 [0,1,1,0,0,0|2,0,0]=4 1508 B16R2.2959 Clc1ccccc1CNCC2CCCC2 34a_100000174879_100000740388 [0,1,1,0,0,0|2,0,0]=4 1509 B16R2.2959 Clc1ccccc1CNCC2CCCC2 34a_100000737975_100000187162 [0,1,1,0,0,0|2,0,0]=4 1510 B16R2.2959 Clc1ccccc1COCC2CCCC2 34a_100000210847_100000740388 [0,1,1,0,0,0|2,0,0]=4 1511 B16R2.2959 Clc1ccccc1COCC2CCCC2 34a_100000742336_100000187162 [0,1,1,0,0,0|2,0,0]=4 1512 B16R2.2959 Clc1ccccc1COCC2CCCC2 7a_100000210847_100000740388 [0,1,1,0,0,0|2,0,0]=4 1513 B16R2.2959 Clc1ccccc1COCC2CCCC2 7a_100000742336_100000187162 [0,1,1,0,0,0|2,0,0]=4 1514 B16R2.2959 Clc1ccccc1CSCC2CCCC2 62a_100000187162_100000740388 [0,1,1,0,0,0|2,0,0]=4 1515 B16R2.2959 Clc1ccccc1CSCC2CCCC2 62a_100000740388_100000187162 [0,1,1,0,0,0|2,0,0]=4 1516 B16R2.2959 Clc1ccccc1NCCC2CCCC2 34a_100000185783_100000760354 [0,1,1,0,0,0|2,0,0]=4 1517 B16R2.2959 Clc1ccccc1OCCC2CCCC2 34a_100000210172_100000760354 [0,1,1,0,0,0|2,0,0]=4 1518 B16R2.2959 Clc1ccccc1OCCC2CCCC2 7a_100000210172_100000760354 [0,1,1,0,0,0|2,0,0]=4 1519 B16R2.2959 Clc1ccccc1SCCC2CCCC2 62a_100000760354_100000764095 [0,1,1,0,0,0|2,0,0]=4 1520 B16R2.2959 Clc1ccccc1SCCC2CCCC2 62a_100000764095_100000760354 [0,1,1,0,0,0|2,0,0]=4 1521 B16R2.2959 Fc1ccccc1C=NNC2CCCC2 4a_100000737850_100000210811 [0,1,1,0,0,0|1,0,1]=4 1522 B16R2.2959 Fc1ccccc1CCNC2CC=CC2 2230a_100015188752_100011713696 [0,1,1,0,0,0|0,0,2]=4 1523 B16R2.2959 Fc1ccccc1CCNC2CCCC2 2230a_100000185272_100000179811 [0,1,1,0,0,0|0,0,0]=2 1524 B16R2.2959 Fc1ccccc1CCNC2CCCC2 2230a_100000211070_100011713696 [0,1,1,0,0,0|0,0,0]=2 1525 B16R2.2959 Fc1ccccc1CCNC2CCCC2 270004a_100000185272_100000210133 [0,1,1,0,0,0|0,0,0]=2 1526 B16R2.2959 Fc1ccccc1CCNC2CCCC2 34a_100000185272_100000179811 [0,1,1,0,0,0|0,0,0]=2 1527 B16R2.2959 Fc1ccccc1CCNC2CCCC2 34a_100000211070_100000720011 [0,1,1,0,0,0|0,0,0]=2 1528 B16R2.2959 Fc1ccccc1CCNC2CCOC2 2230a_100000185272_100000731011 [0,1,1,0,0,0|1,0,0]=3 1529 B16R2.2959 Fc1ccccc1CCNC2CCOC2 270004a_100000185272_100000752484 [0,1,1,0,0,0|1,0,0]=3 1530 B16R2.2959 Fc1ccccc1CCNC2CCOC2 34a_100000185272_100000690089 [0,1,1,0,0,0|1,0,0]=3 1531 B16R2.2959 Fc1ccccc1CCNC2CCSC2 270004a_100000185272_100000212027 [0,1,1,0,0,0|1,0,0]=3 1532 B16R2.2959 Fc1ccccc1CCN[C@@H]2CCOC2 2230a_200015188469_100011713696 [0,1,1,0,0,0|1,0,0]=3 1533 B16R2.2959 Fc1ccccc1CCN[C@H]2CCOC2 2230a_100015188467_100011713696 [0,1,1,0,0,0|1,0,0]=3 1534 B16R2.2959 Fc1ccccc1CCN[C@H]2CCOC2 34a_100015188467_100000720011 [0,1,1,0,0,0|1,0,0]=3 1535 B16R2.2959 Fc1ccccc1CCOC2CCCC2 34a_100000210269_100000720011 [0,1,1,0,0,0|1,0,0]=3 1536 B16R2.2959 Fc1ccccc1CCOC2CCCC2 34a_100000753711_100000179811 [0,1,1,0,0,0|1,0,0]=3 1537 B16R2.2959 Fc1ccccc1CCOC2CCCC2 7a_100000210269_100000720011 [0,1,1,0,0,0|1,0,0]=3 1538 B16R2.2959 Fc1ccccc1CCOC2CCCC2 7a_100000753711_100000179811 [0,1,1,0,0,0|1,0,0]=3 1539 B16R2.2959 Fc1ccccc1CCOC2CCCO2 34a_100000085407_100000720011 [0,1,1,0,0,0|2,0,0]=4 1540 B16R2.2959 Fc1ccccc1CCOC2CCOC2 34a_100000753711_100000690089 [0,1,1,0,0,0|2,0,0]=4 1541 B16R2.2959 Fc1ccccc1CCOC2CCOC2 7a_100000753711_100000731011 [0,1,1,0,0,0|2,0,0]=4 1542 B16R2.2959 Fc1ccccc1CCOC2CCSC2 7a_100011232664_100000720011 [0,1,1,0,0,0|2,0,0]=4 1543 B16R2.2959 Fc1ccccc1CCO[C@H]2CCOC2 34a_100000717292_100000720011 [0,1,1,0,0,0|2,0,0]=4 1544 B16R2.2959 Fc1ccccc1CCSC2CCCC2 62a_100011217020_100011713696 [0,1,1,0,0,0|1,0,0]=3 1545 B16R2.2959 Fc1ccccc1CCSC2CCCC2 62a_100011713696_100000179811 [0,1,1,0,0,0|1,0,0]=3 1546 B16R2.2959 Fc1ccccc1CCSC2CCOC2 62a_100011713696_100000690089 [0,1,1,0,0,0|2,0,0]=4 1547 B16R2.2959 Fc1ccccc1CNCC2CCCC2 207a_100000737975_100000210811 [0,1,1,0,0,0|2,0,0]=4 1548 B16R2.2959 Fc1ccccc1CNCC2CCCC2 2230a_100000737975_100000211605 [0,1,1,0,0,0|2,0,0]=4 1549 B16R2.2959 Fc1ccccc1CNCC2CCCC2 269862a_100000174869_100000746403 [0,1,1,0,0,0|2,0,0]=4 1550 B16R2.2959 Fc1ccccc1CNCC2CCCC2 270004a_100000737975_100000210811 [0,1,1,0,0,0|2,0,0]=4 1551 B16R2.2959 Fc1ccccc1CNCC2CCCC2 34a_100000174869_100000740388 [0,1,1,0,0,0|2,0,0]=4 1552 B16R2.2959 Fc1ccccc1CNCC2CCCC2 34a_100000737975_100000211605 [0,1,1,0,0,0|2,0,0]=4 1553 B16R2.2959 Fc1ccccc1COCC2CCCC2 34a_100000211962_100000740388 [0,1,1,0,0,0|2,0,0]=4 1554 B16R2.2959 Fc1ccccc1COCC2CCCC2 34a_100000742336_100000211605 [0,1,1,0,0,0|2,0,0]=4 1555 B16R2.2959 Fc1ccccc1COCC2CCCC2 7a_100000211962_100000740388 [0,1,1,0,0,0|2,0,0]=4 1556 B16R2.2959 Fc1ccccc1COCC2CCCC2 7a_100000742336_100000211605 [0,1,1,0,0,0|2,0,0]=4 1557 B16R2.2959 Fc1ccccc1CSCC2CCCC2 62a_100000211605_100000740388 [0,1,1,0,0,0|2,0,0]=4 1558 B16R2.2959 Fc1ccccc1CSCC2CCCC2 62a_100000740388_100000211605 [0,1,1,0,0,0|2,0,0]=4 1559 B16R2.2959 Fc1ccccc1NCCC2CCCC2 34a_100000210422_100000760354 [0,1,1,0,0,0|2,0,0]=4 1560 B16R2.2959 Fc1ccccc1OCCC2CCCC2 34a_100000210171_100000760354 [0,1,1,0,0,0|2,0,0]=4 1561 B16R2.2959 Fc1ccccc1OCCC2CCCC2 7a_100000210171_100000760354 [0,1,1,0,0,0|2,0,0]=4 1562 B16R2.2959 Fc1ccccc1SCCC2CCCC2 62a_100000760354_100011215700 [0,1,1,0,0,0|2,0,0]=4 1563 B16R2.2959 Fc1ccccc1SCCC2CCCC2 62a_100011215700_100000760354 [0,1,1,0,0,0|2,0,0]=4 1564 B16R2.2959 Ic1ccccc1C=NNC2CCCC2 4a_100000737850_100000010305 [0,1,1,0,0,0|1,0,1]=4 1565 B16R2.2959 Ic1ccccc1CCOC2CCCC2 34a_100010255290_100000179811 [0,1,1,0,0,0|1,0,0]=3 1566 B16R2.2959 Ic1ccccc1CCOC2CCCC2 7a_100010255290_100000179811 [0,1,1,0,0,0|1,0,0]=3 1567 B16R2.2959 Ic1ccccc1CCOC2CCOC2 34a_100010255290_100000690089 [0,1,1,0,0,0|2,0,0]=4 1568 B16R2.2959 Ic1ccccc1CCOC2CCOC2 7a_100010255290_100000731011 [0,1,1,0,0,0|2,0,0]=4 1569 B16R2.2959 Ic1ccccc1CNCC2CCCC2 207a_100000737975_100000010305 [0,1,1,0,0,0|2,0,0]=4 1570 B16R2.2959 Ic1ccccc1CNCC2CCCC2 2230a_100000737975_100011215278 [0,1,1,0,0,0|2,0,0]=4 1571 B16R2.2959 Ic1ccccc1CNCC2CCCC2 269862a_100015347259_100000746403 [0,1,1,0,0,0|2,0,0]=4 1572 B16R2.2959 Ic1ccccc1CNCC2CCCC2 270004a_100000737975_100000010305 [0,1,1,0,0,0|2,0,0]=4 1573 B16R2.2959 Ic1ccccc1CNCC2CCCC2 34a_100000737975_100011215278 [0,1,1,0,0,0|2,0,0]=4 1574 B16R2.2959 Ic1ccccc1COCC2CCCC2 34a_100000187465_100000740388 [0,1,1,0,0,0|2,0,0]=4 1575 B16R2.2959 Ic1ccccc1COCC2CCCC2 34a_100000742336_100011215278 [0,1,1,0,0,0|2,0,0]=4 1576 B16R2.2959 Ic1ccccc1COCC2CCCC2 7a_100000187465_100000740388 [0,1,1,0,0,0|2,0,0]=4 1577 B16R2.2959 Ic1ccccc1COCC2CCCC2 7a_100000742336_100011215278 [0,1,1,0,0,0|2,0,0]=4 1578 B16R2.2959 Ic1ccccc1CSCC2CCCC2 62a_100000740388_100011216222 [0,1,1,0,0,0|2,0,0]=4 1579 B16R2.2959 Ic1ccccc1CSCC2CCCC2 62a_100011216222_100000740388 [0,1,1,0,0,0|2,0,0]=4 1580 B16R2.2959 Ic1ccccc1NCCC2CCCC2 34a_100000210053_100000760354 [0,1,1,0,0,0|2,0,0]=4 1581 B16R2.2959 Ic1ccccc1OCCC2CCCC2 34a_100000739446_100000760354 [0,1,1,0,0,0|2,0,0]=4 1582 B16R2.2959 Ic1ccccc1OCCC2CCCC2 7a_100000739446_100000760354 [0,1,1,0,0,0|2,0,0]=4 1583 B16R2.2959 Nc1ccccc1CCOC2CCCC2 34a_100011215289_100000179811 [0,1,1,0,0,0|1,0,0]=3 1584 B16R2.2959 Nc1ccccc1CCOC2CCOC2 34a_100011215289_100000690089 [0,1,1,0,0,0|2,0,0]=4 1585 B16R2.2959 Nc1ccccc1COCC2CCCC2 34a_100000212039_100000740388 [0,1,1,0,0,0|2,0,0]=4 1586 B16R2.2959 Nc1ccccc1OCCC2CCCC2 34a_100000185747_100000760354 [0,1,1,0,0,0|2,0,0]=4 1587 B16R2.2959 Nc1ccccc1OCCC2CCCC2 7a_100000185747_100000760354 [0,1,1,0,0,0|2,0,0]=4 1588 B16R2.2959 Nc1ccccc1SCCC2CCCC2 62a_100000210017_100000760354 [0,1,1,0,0,0|2,0,0]=4 1589 B16R2.2959 Nc1ccccc1SCCC2CCCC2 62a_100000760354_100000210017 [0,1,1,0,0,0|2,0,0]=4 1590 B16R2.2959 O=c1ccccn1CCNC2CCCC2 2230a_100000687133_100000179811 [0,1,1,0,0,0|1,0,0]=3 1591 B16R2.2959 O=c1ccccn1CCNC2CCOC2 2230a_100000687133_100000731011 [0,1,1,0,0,0|2,0,0]=4 1592 B16R2.2959 Oc1ccccc1C=NNC2CCCC2 4a_100000737850_100000185834 [0,1,1,0,0,0|1,0,1]=4 1593 B16R2.2959 Oc1ccccc1CCNC2CCCC2 270004a_100011207237_100000210133 [0,1,1,0,0,0|0,0,0]=2 1594 B16R2.2959 Oc1ccccc1CCNC2CCCC2 34a_100000211070_100000722297 [0,1,1,0,0,0|0,0,0]=2 1595 B16R2.2959 Oc1ccccc1CCNC2CCCC2 34a_100011207237_100000179811 [0,1,1,0,0,0|0,0,0]=2 1596 B16R2.2959 Oc1ccccc1CCNC2CCOC2 270004a_100011207237_100000752484 [0,1,1,0,0,0|1,0,0]=3 1597 B16R2.2959 Oc1ccccc1CCNC2CCOC2 34a_100011207237_100000690089 [0,1,1,0,0,0|1,0,0]=3 1598 B16R2.2959 Oc1ccccc1CCNC2CCSC2 270004a_100011207237_100000212027 [0,1,1,0,0,0|1,0,0]=3 1599 B16R2.2959 Oc1ccccc1CCN[C@H]2CCOC2 34a_100015188467_100000722297 [0,1,1,0,0,0|1,0,0]=3 1600 B16R2.2959 Oc1ccccc1CCOC2CCCC2 34a_100000210269_100000722297 [0,1,1,0,0,0|1,0,0]=3 1601 B16R2.2959 Oc1ccccc1CCOC2CCCC2 7a_100000210269_100000722297 [0,1,1,0,0,0|1,0,0]=3 1602 B16R2.2959 Oc1ccccc1CCOC2CCCO2 34a_100000085407_100000722297 [0,1,1,0,0,0|2,0,0]=4 1603 B16R2.2959 Oc1ccccc1CCOC2CCSC2 7a_100011232664_100000722297 [0,1,1,0,0,0|2,0,0]=4 1604 B16R2.2959 Oc1ccccc1CCO[C@H]2CCOC2 34a_100000717292_100000722297 [0,1,1,0,0,0|2,0,0]=4 1605 B16R2.2959 Oc1ccccc1CCSC2CCCC2 62a_100000722297_100000179811 [0,1,1,0,0,0|1,0,0]=3 1606 B16R2.2959 Oc1ccccc1CCSC2CCCC2 62a_100011217020_100000722297 [0,1,1,0,0,0|1,0,0]=3 1607 B16R2.2959 Oc1ccccc1CCSC2CCOC2 62a_100000722297_100000690089 [0,1,1,0,0,0|2,0,0]=4 1608 B16R2.2959 Oc1ccccc1CNCC2CCCC2 269862a_100000185550_100000746403 [0,1,1,0,0,0|2,0,0]=4 1609 B16R2.2959 Oc1ccccc1CNCC2CCCC2 34a_100000185550_100000740388 [0,1,1,0,0,0|2,0,0]=4 1610 B16R2.2959 Oc1ccccc1NCCC2CCCC2 34a_100000185747_100000760354 [0,1,1,0,0,0|2,0,0]=4 1611 B16R2.2959 Oc1ccccc1SCCC2CCCC2 62a_100000739446_100000760354 [0,1,1,0,0,0|2,0,0]=4 1612 B16R2.2959 Oc1ccccc1SCCC2CCCC2 62a_100000760354_100000739446 [0,1,1,0,0,0|2,0,0]=4 1613 B16R2.3250 CC1CCCC1NCCc2ccccc2 269862a_100000106460_100000752053 [0,1,1,0,0,0|0,0,0]=2 1614 B16R2.3250 CC1CCCC1NCCc2ccccn2 269862a_100000211156_100000752053 [0,1,1,0,0,0|1,0,0]=3 1615 B16R2.3250 CC1CCCC1NCCc2cccnc2 269862a_100000736294_100000752053 [0,1,1,0,0,0|1,0,0]=3 1616 B16R2.3250 CC1CCCC1NCCc2ccncc2 269862a_100000742849_100000752053 [0,1,1,0,0,0|1,0,0]=3 1617 B16R2.3250 CC1CCCC1NCCc2cnccn2 269862a_100000723456_100000752053 [0,1,1,0,0,0|2,0,0]=4 1618 B16R2.3250 CC1CCCC1OCCc2ccccc2 34a_100011216460_100000765856 [0,1,1,0,0,0|1,0,0]=3 1619 B16R2.3250 CC1CCCC1OCCc2ccccc2 7a_100011216460_100000765856 [0,1,1,0,0,0|1,0,0]=3 1620 B16R2.3250 CC1CCCC1OCCc2ccccn2 7a_100011216460_100015183660 [0,1,1,0,0,0|2,0,0]=4 1621 B16R2.3250 CC1CCCC1OCCc2cccnc2 7a_100011216460_200011713674 [0,1,1,0,0,0|2,0,0]=4 1622 B16R2.3250 CC1CCCC1OCCc2ccncc2 7a_100011216460_100000723409 [0,1,1,0,0,0|2,0,0]=4 1623 B16R2.3250 CC1OCCC1NCCc2ccccc2 270004a_100000106460_100000691750 [0,1,1,0,0,0|1,0,0]=3 1624 B16R2.3250 CC1OCCC1NCCc2ccccn2 270004a_100000211156_100000691750 [0,1,1,0,0,0|2,0,0]=4 1625 B16R2.3250 CC1OCCC1NCCc2cccnc2 270004a_100000736294_100000691750 [0,1,1,0,0,0|2,0,0]=4 1626 B16R2.3250 CC1OCCC1NCCc2ccncc2 270004a_100000742849_100000691750 [0,1,1,0,0,0|2,0,0]=4 1627 B16R2.3250 C[C@@H]1CCCN1CCCc2ccccc2 2230a_100015189458_100000211621 [0,1,1,0,0,0|2,0,0]=4 1628 B16R2.3250 C[C@@H]1CCCN1CCCc2ccccc2 269982a_100015189458_100000211621 [0,1,1,0,0,0|2,0,0]=4 1629 B16R2.3250 C[C@@H]1CCCN1CCCc2ccccc2 34a_100015189458_100000211621 [0,1,1,0,0,0|2,0,0]=4 1630 B16R2.3250 C[C@@H]1CNC[C@@H]1OCCc2ccccc2 34a_200015306588_100000765856 [0,1,1,0,0,0|2,0,0]=4 1631 B16R2.3250 C[C@H]1CCCN1CCCc2ccccc2 2230a_100020605311_100000211621 [0,1,1,0,0,0|2,0,0]=4 1632 B16R2.3250 C[C@H]1CCCN1CCCc2ccccc2 269982a_100020605311_100000211621 [0,1,1,0,0,0|2,0,0]=4 1633 B16R2.3250 Cl[C@@H]1CCC[C@H]1OCCc2ccccc2 34a_200016002552_100000765856 [0,1,1,0,0,0|1,0,0]=3 1634 B16R2.3250 N[C@H]1CCC[C@@H]1OCCc2ccccc2 34a_100000748460_100000765856 [0,1,1,0,0,0|1,0,0]=3 1635 B16R2.3250 N[C@H]1COC[C@@H]1OCCc2ccccc2 34a_100015191717_100000765856 [0,1,1,0,0,0|2,0,0]=4 1636 B16R2.3250 O=C1CCCC1NCCc2ccccc2 2230a_100000106460_100000211823 [0,1,1,0,0,0|0,0,1]=3 1637 B16R2.3250 O=C1CCCC1NCCc2ccccc2 34a_100000106460_100000709159 [0,1,1,0,0,0|0,0,1]=3 1638 B16R2.3250 O=C1CCCC1NCCc2cccnc2 2230a_100000736294_100000211823 [0,1,1,0,0,0|1,0,1]=4 1639 B16R2.3250 O=C1CCCC1OCCc2ccccc2 34a_100000210268_100000709159 [0,1,1,0,0,0|1,0,1]=4 1640 B16R2.3250 O=C1CCCC1OCCc2ccccc2 34a_200000719330_100000765856 [0,1,1,0,0,0|1,0,1]=4 1641 B16R2.3250 O=C1CCCC1OCCc2ccccc2 7a_100000210268_100000211823 [0,1,1,0,0,0|1,0,1]=4 1642 B16R2.3250 O=C1CCCC1SCCc2ccccc2 62a_100000211823_100011218657 [0,1,1,0,0,0|1,0,1]=4 1643 B16R2.3250 O=C1CCCC1SCCc2ccccc2 62a_100000765856_100000211823 [0,1,1,0,0,0|1,0,1]=4 1644 B16R2.3250 O=C1NCCC1NCCc2ccccc2 2230a_100016995588_100000765856 [0,1,1,0,0,0|1,0,1]=4 1645 B16R2.3250 O=C1NCCC1NCCc2ccccc2 34a_100016995588_100000765856 [0,1,1,0,0,0|1,0,1]=4 1646 B16R2.3250 O=C1OCCC1NCCc2ccccc2 2230a_100000106460_100000211211 [0,1,1,0,0,0|1,0,1]=4 1647 B16R2.3250 O=C1OCCC1NCCc2ccccc2 34a_100000106460_100000211211 [0,1,1,0,0,0|1,0,1]=4 1648 B16R2.3250 OC1COCC1NCCc2ccccc2 34a_100000106460_200000725654 [0,1,1,0,0,0|1,0,0]=3 1649 B16R2.3250 OC1COCC1OCCc2ccccc2 34a_100000210268_200000725654 [0,1,1,0,0,0|2,0,0]=4 1650 B16R2.3250 OC1COCC1OCCc2ccccc2 7a_100000210268_200000725654 [0,1,1,0,0,0|2,0,0]=4 1651 B16R2.3250 OC1COCC1SCCc2ccccc2 62a_100000765856_200000725654 [0,1,1,0,0,0|2,0,0]=4 1652 B16R2.3250 OC1COCC1SCCc2ccccc2 62a_200000725654_100011218657 [0,1,1,0,0,0|2,0,0]=4 1653 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2ccccc2 62a_100000765856_200016002552 [0,1,1,0,0,0|1,0,0]=3 1654 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2ccccc2 62a_200016002552_100011218657 [0,1,1,0,0,0|1,0,0]=3 1655 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2ccccn2 62a_100015183660_200016002552 [0,1,1,0,0,0|2,0,0]=4 1656 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2ccccn2 62a_200016002552_100015183660 [0,1,1,0,0,0|2,0,0]=4 1657 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2cccnc2 62a_200011713674_200016002552 [0,1,1,0,0,0|2,0,0]=4 1658 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2cccnc2 62a_200016002552_200011713674 [0,1,1,0,0,0|2,0,0]=4 1659 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2ccncc2 62a_100000723409_200016002552 [0,1,1,0,0,0|2,0,0]=4 1660 B16R2.3250 O[C@@H]1CCC[C@H]1SCCc2ccncc2 62a_200016002552_100000723409 [0,1,1,0,0,0|2,0,0]=4 1661 B16R2.3250 O[C@@H]1CCC[C@H]1SCSc2ccccc2 62a_100011218342_200016002552 [0,1,1,0,0,0|2,0,0]=4 1662 B16R2.3250 O[C@@H]1CCC[C@H]1SCSc2ccccc2 62a_200016002552_100011218342 [0,1,1,0,0,0|2,0,0]=4 1663 B16R2.3250 O[C@H]1COC[C@@H]1NCCc2ccccc2 2230a_100015191717_100000765856 [0,1,1,0,0,0|1,0,0]=3 1664 B16R2.3250 O[C@H]1COC[C@@H]1NCCc2ccccn2 2230a_100015191717_100015183660 [0,1,1,0,0,0|2,0,0]=4 1665 B16R2.3250 O[C@H]1COC[C@@H]1NCCc2cccnc2 2230a_100015191717_200011713674 [0,1,1,0,0,0|2,0,0]=4 1666 B16R2.3250 O[C@H]1COC[C@@H]1NCCc2ccncc2 2230a_100015191717_100000723409 [0,1,1,0,0,0|2,0,0]=4 1667 B16R2.3250 O[C@H]1COC[C@@H]1NCSc2ccccc2 2230a_100015191717_100011218342 [0,1,1,0,0,0|2,0,0]=4 1668 B16R2.5767 CC(=NNC1CCCC1)c2ccccc2 4a_100000737850_100000185851 [0,1,1,0,0,0|1,0,1]=4 1669 B16R2.5767 CC(CCN1CCCC1)c2ccccc2 270004a_100000188435_100000189432 [0,1,1,0,0,0|2,0,0]=4 1670 B16R2.5767 CC(CNC1CC=CC1)c2ccccc2 2230a_100015188752_100000756946 [0,1,1,0,0,0|0,0,2]=4 1671 B16R2.5767 CC(CNC1CC=CC1)c2ccccc2 270004a_100015188752_100000212034 [0,1,1,0,0,0|0,0,2]=4 1672 B16R2.5767 CC(CNC1CCCC1)c2ccccc2 2230a_100000211070_100000756946 [0,1,1,0,0,0|0,0,0]=2 1673 B16R2.5767 CC(CNC1CCCC1)c2ccccc2 2230a_100000701038_100000179811 [0,1,1,0,0,0|0,0,0]=2 1674 B16R2.5767 CC(CNC1CCCC1)c2ccccc2 270004a_100000211070_100000212034 [0,1,1,0,0,0|0,0,0]=2 1675 B16R2.5767 CC(CNC1CCCC1)c2ccccc2 270004a_100000701038_100000210133 [0,1,1,0,0,0|0,0,0]=2 1676 B16R2.5767 CC(CNC1CCCC1)c2ccccc2 34a_100000211070_100000756946 [0,1,1,0,0,0|0,0,0]=2 1677 B16R2.5767 CC(CNC1CCCC1)c2ccccc2 34a_100000701038_100000179811 [0,1,1,0,0,0|0,0,0]=2 1678 B16R2.5767 CC(CNC1CCOC1)c2ccccc2 2230a_100000701038_100000731011 [0,1,1,0,0,0|1,0,0]=3 1679 B16R2.5767 CC(CNC1CCOC1)c2ccccc2 270004a_100000701038_100000752484 [0,1,1,0,0,0|1,0,0]=3 1680 B16R2.5767 CC(CNC1CCOC1)c2ccccc2 34a_100000701038_100000690089 [0,1,1,0,0,0|1,0,0]=3 1681 B16R2.5767 CC(CNC1CCSC1)c2ccccc2 270004a_100000701038_100000212027 [0,1,1,0,0,0|1,0,0]=3 1682 B16R2.5767 CC(CN[C@@H]1CCOC1)c2ccccc2 2230a_200015188469_100000756946 [0,1,1,0,0,0|1,0,0]=3 1683 B16R2.5767 CC(CN[C@@H]1CCOC1)c2ccccc2 270004a_200015188469_100000212034 [0,1,1,0,0,0|1,0,0]=3 1684 B16R2.5767 CC(CN[C@H]1CCOC1)c2ccccc2 2230a_100015188467_100000756946 [0,1,1,0,0,0|1,0,0]=3 1685 B16R2.5767 CC(CN[C@H]1CCOC1)c2ccccc2 270004a_100015188467_100000212034 [0,1,1,0,0,0|1,0,0]=3 1686 B16R2.5767 CC(CN[C@H]1CCOC1)c2ccccc2 34a_100015188467_100000756946 [0,1,1,0,0,0|1,0,0]=3 1687 B16R2.5767 CC(COC1CCCC1)c2ccccc2 34a_100000210269_100000756946 [0,1,1,0,0,0|1,0,0]=3 1688 B16R2.5767 CC(COC1CCCC1)c2ccccc2 34a_100011215166_100000179811 [0,1,1,0,0,0|1,0,0]=3 1689 B16R2.5767 CC(COC1CCCC1)c2ccccc2 7a_100000210269_100000756946 [0,1,1,0,0,0|1,0,0]=3 1690 B16R2.5767 CC(COC1CCCC1)c2ccccc2 7a_100011215166_100000179811 [0,1,1,0,0,0|1,0,0]=3 1691 B16R2.5767 CC(COC1CCCO1)c2ccccc2 34a_100000085407_100000756946 [0,1,1,0,0,0|2,0,0]=4 1692 B16R2.5767 CC(COC1CCOC1)c2ccccc2 34a_100011215166_100000690089 [0,1,1,0,0,0|2,0,0]=4 1693 B16R2.5767 CC(COC1CCOC1)c2ccccc2 7a_100011215166_100000731011 [0,1,1,0,0,0|2,0,0]=4 1694 B16R2.5767 CC(COC1CCSC1)c2ccccc2 7a_100011232664_100000756946 [0,1,1,0,0,0|2,0,0]=4 1695 B16R2.5767 CC(CO[C@H]1CCOC1)c2ccccc2 34a_100000717292_100000756946 [0,1,1,0,0,0|2,0,0]=4 1696 B16R2.5767 CC(CSC1CCCC1)c2ccccc2 62a_100000756946_100000179811 [0,1,1,0,0,0|1,0,0]=3 1697 B16R2.5767 CC(CSC1CCCC1)c2ccccc2 62a_100011217020_100000756946 [0,1,1,0,0,0|1,0,0]=3 1698 B16R2.5767 CC(CSC1CCOC1)c2ccccc2 62a_100000756946_100000690089 [0,1,1,0,0,0|2,0,0]=4 1699 B16R2.5767 CC(NCC1CCCC1)c2ccccc2 2230a_100000737975_100000230085 [0,1,1,0,0,0|2,0,0]=4 1700 B16R2.5767 CC(NCC1CCCC1)c2ccccc2 269862a_100000737975_100000185851 [0,1,1,0,0,0|2,0,0]=4 1701 B16R2.5767 CC(NCC1CCCC1)c2ccccc2 34a_100000737975_100000211855 [0,1,1,0,0,0|2,0,0]=4 1702 B16R2.5767 CC(OCC1CCCC1)c2ccccc2 34a_100000742336_100000211855 [0,1,1,0,0,0|2,0,0]=4 1703 B16R2.5767 CC(OCC1CCCC1)c2ccccc2 7a_100000742336_100000230085 [0,1,1,0,0,0|2,0,0]=4 1704 B16R2.5767 CC(SCC1CCCC1)c2ccccc2 62a_100000230085_100000740388 [0,1,1,0,0,0|2,0,0]=4 1705 B16R2.5767 CC(SCC1CCCC1)c2ccccc2 62a_100000740388_100000230085 [0,1,1,0,0,0|2,0,0]=4 1706 B16R2.5767 CN(CCC1CCCC1)c2ccccc2 2230a_100000210012_100000760354 [0,1,1,0,0,0|2,0,0]=4 1707 B16R2.5767 CN(CCC1CCCC1)c2ccccc2 269982a_100000210012_100000760354 [0,1,1,0,0,0|2,0,0]=4 1708 B16R2.5767 CN(CCC1CCCC1)c2ccccc2 34a_100000210012_100000760354 [0,1,1,0,0,0|2,0,0]=4 1709 B16R2.5767 C[C@@H](NCC1CCCC1)c2ccccc2 2230a_100000751104_100000740388 [0,1,1,0,0,0|2,0,0]=4 1710 B16R2.5767 C[C@@H](NCC1CCCC1)c2ccccc2 269862a_100000751104_100000746403 [0,1,1,0,0,0|2,0,0]=4 1711 B16R2.5767 C[C@@H](OCC1CCCC1)c2ccccc2 34a_100000761318_100000740388 [0,1,1,0,0,0|2,0,0]=4 1712 B16R2.5767 C[C@@H](OCC1CCCC1)c2ccccc2 7a_100000761318_100000740388 [0,1,1,0,0,0|2,0,0]=4 1713 B16R2.5767 N[C@H](COC1CCCC1)c2ccccc2 34a_100000751927_100000179811 [0,1,1,0,0,0|1,0,0]=3 1714 B16R2.5767 N[C@H](COC1CCCC1)c2ccncc2 34a_100138412524_100000179811 [0,1,1,0,0,0|2,0,0]=4 1715 B16R2.5767 N[C@H](COC1CCOC1)c2ccccc2 34a_100000751927_100000690089 [0,1,1,0,0,0|2,0,0]=4 1716 B16R2.5767 O=C(CCC1CCCC1)c2ccccc2 1458a_100000185807_100000760354 [0,1,1,0,0,0|1,0,1]=4 1717 B16R2.5767 O=C(CNC1CCCC1)c2ccccn2 34a_100000211070_100000027445 [0,1,1,0,0,0|1,0,1]=4 1718 B16R2.5767 O=C(COC1CCCC1)c2ccccc2 7a_100000210269_100000211460 [0,1,1,0,0,0|1,0,1]=4 1719 B16R2.5767 O=C(CSC1CCCC1)c2ccccc2 62a_100000211460_100000179811 [0,1,1,0,0,0|1,0,1]=4 1720 B16R2.5767 O=C(CSC1CCCC1)c2ccccc2 62a_100011217020_100000211460 [0,1,1,0,0,0|1,0,1]=4 1721 B16R2.5767 O=C(NNC1CCCC1)c2ccccc2 22a_100000737850_100000185807 [0,1,1,0,0,0|1,0,1]=4 1722 B16R2.5767 O=S(CSC1CCCC1)c2ccccc2 62a_100011217020_100000031784 [0,1,1,0,0,0|2,0,0]=4 1723 B16R2.5767 OC(CNC1CC=CC1)c2ccccc2 2230a_100015188752_100000185958 [0,1,1,0,0,0|0,0,2]=4 1724 B16R2.5767 OC(CNC1CCCC1)c2ccccc2 2230a_100000210709_100000179811 [0,1,1,0,0,0|0,0,0]=2 1725 B16R2.5767 OC(CNC1CCCC1)c2ccccc2 2230a_100000211070_100000185958 [0,1,1,0,0,0|0,0,0]=2 1726 B16R2.5767 OC(CNC1CCCC1)c2ccccc2 270004a_100000210709_100000210133 [0,1,1,0,0,0|0,0,0]=2 1727 B16R2.5767 OC(CNC1CCCC1)c2ccccc2 34a_100000211070_100000185958 [0,1,1,0,0,0|0,0,0]=2 1728 B16R2.5767 OC(CNC1CCCC1)c2ccccn2 2230a_100000691469_100000179811 [0,1,1,0,0,0|1,0,0]=3 1729 B16R2.5767 OC(CNC1CCCC1)c2ccccn2 270004a_100000691469_100000210133 [0,1,1,0,0,0|1,0,0]=3 1730 B16R2.5767 OC(CNC1CCCC1)c2cccnc2 2230a_100020605170_100000179811 [0,1,1,0,0,0|1,0,0]=3 1731 B16R2.5767 OC(CNC1CCCC1)c2cccnc2 270004a_100020605170_100000210133 [0,1,1,0,0,0|1,0,0]=3 1732 B16R2.5767 OC(CNC1CCOC1)c2ccccc2 2230a_100000210709_100000731011 [0,1,1,0,0,0|1,0,0]=3 1733 B16R2.5767 OC(CNC1CCOC1)c2ccccc2 270004a_100000210709_100000752484 [0,1,1,0,0,0|1,0,0]=3 1734 B16R2.5767 OC(CNC1CCOC1)c2ccccn2 2230a_100000691469_100000731011 [0,1,1,0,0,0|2,0,0]=4 1735 B16R2.5767 OC(CNC1CCOC1)c2ccccn2 270004a_100000691469_100000752484 [0,1,1,0,0,0|2,0,0]=4 1736 B16R2.5767 OC(CNC1CCOC1)c2cccnc2 2230a_100020605170_100000731011 [0,1,1,0,0,0|2,0,0]=4 1737 B16R2.5767 OC(CNC1CCOC1)c2cccnc2 270004a_100020605170_100000752484 [0,1,1,0,0,0|2,0,0]=4 1738 B16R2.5767 OC(CNC1CCSC1)c2ccccc2 270004a_100000210709_100000212027 [0,1,1,0,0,0|1,0,0]=3 1739 B16R2.5767 OC(CNC1CCSC1)c2ccccn2 270004a_100000691469_100000212027 [0,1,1,0,0,0|2,0,0]=4 1740 B16R2.5767 OC(CNC1CCSC1)c2cccnc2 270004a_100020605170_100000212027 [0,1,1,0,0,0|2,0,0]=4 1741 B16R2.5767 OC(CN[C@@H]1CCOC1)c2ccccc2 2230a_200015188469_100000185958 [0,1,1,0,0,0|1,0,0]=3 1742 B16R2.5767 OC(CN[C@H]1CCOC1)c2ccccc2 2230a_100015188467_100000185958 [0,1,1,0,0,0|1,0,0]=3 1743 B16R2.5767 OC(CN[C@H]1CCOC1)c2ccccc2 34a_100015188467_100000185958 [0,1,1,0,0,0|1,0,0]=3 1744 B16R2.5767 OC(COC1CCCC1)c2ccccc2 34a_100000210269_100000185958 [0,1,1,0,0,0|1,0,0]=3 1745 B16R2.5767 OC(COC1CCCC1)c2ccccc2 7a_100000210269_100000185958 [0,1,1,0,0,0|1,0,0]=3 1746 B16R2.5767 OC(COC1CCCO1)c2ccccc2 34a_100000085407_100000185958 [0,1,1,0,0,0|2,0,0]=4 1747 B16R2.5767 OC(COC1CCSC1)c2ccccc2 7a_100011232664_100000185958 [0,1,1,0,0,0|2,0,0]=4 1748 B16R2.5767 OC(CO[C@H]1CCOC1)c2ccccc2 34a_100000717292_100000185958 [0,1,1,0,0,0|2,0,0]=4 1749 B16R2.5767 OC(CSC1CCCC1)c2ccccc2 62a_100000185958_100000179811 [0,1,1,0,0,0|1,0,0]=3 1750 B16R2.5767 OC(CSC1CCCC1)c2ccccc2 62a_100011217020_100000185958 [0,1,1,0,0,0|1,0,0]=3 1751 B16R2.5767 OC(CSC1CCOC1)c2ccccc2 62a_100000185958_100000690089 [0,1,1,0,0,0|2,0,0]=4 1752 B16R2.5767 O[C@H](CCN1CCCC1)c2ccccc2 2230a_100000188435_100000729684 [0,1,1,0,0,0|2,0,0]=4 1753 B16R2.5767 O[C@H](CCN1CCCC1)c2ccccc2 269982a_100000188435_100000729684 [0,1,1,0,0,0|2,0,0]=4 1754 B16R2.5767 O[C@H](CNC1CC=CC1)c2ccccc2 2230a_100015188752_100011933945 [0,1,1,0,0,0|0,0,2]=4 1755 B16R2.5767 O[C@H](CNC1CCCC1)c2ccccc2 2230a_100000211070_100011933945 [0,1,1,0,0,0|0,0,0]=2 1756 B16R2.5767 O[C@H](CNC1CCCC1)c2ccccc2 34a_100000211070_100011933945 [0,1,1,0,0,0|0,0,0]=2 1757 B16R2.5767 O[C@H](CN[C@@H]1CCOC1)c2ccccc2 2230a_200015188469_100011933945 [0,1,1,0,0,0|1,0,0]=3 1758 B16R2.5767 O[C@H](CN[C@H]1CCOC1)c2ccccc2 2230a_100015188467_100011933945 [0,1,1,0,0,0|1,0,0]=3 1759 B16R2.5767 O[C@H](CN[C@H]1CCOC1)c2ccccc2 34a_100015188467_100011933945 [0,1,1,0,0,0|1,0,0]=3 1760 B16R2.5767 O[C@H](COC1CCCC1)c2ccccc2 34a_100000210269_100011933945 [0,1,1,0,0,0|1,0,0]=3 1761 B16R2.5767 O[C@H](COC1CCCC1)c2ccccc2 7a_100000210269_100011933945 [0,1,1,0,0,0|1,0,0]=3 1762 B16R2.5767 O[C@H](COC1CCCO1)c2ccccc2 34a_100000085407_100011933945 [0,1,1,0,0,0|2,0,0]=4 1763 B16R2.5767 O[C@H](COC1CCSC1)c2ccccc2 7a_100011232664_100011933945 [0,1,1,0,0,0|2,0,0]=4 1764 B16R2.5767 O[C@H](CO[C@H]1CCOC1)c2ccccc2 34a_100000717292_100011933945 [0,1,1,0,0,0|2,0,0]=4 1765 B16R2.5767 O[C@H](CSC1CCCC1)c2ccccc2 62a_100011217020_100011933945 [0,1,1,0,0,0|1,0,0]=3 1766 B16R2.5767 O[C@H](CSC1CCCC1)c2ccccc2 62a_100011933945_100000179811 [0,1,1,0,0,0|1,0,0]=3 1767 B16R2.5767 O[C@H](CSC1CCOC1)c2ccccc2 62a_100011933945_100000690089 [0,1,1,0,0,0|2,0,0]=4 1768 B16R2.14780 CC1(CCCC1)OCCc2ccccc2 34a_100000751722_100000765856 [0,1,1,0,0,0|1,0,0]=3 1769 B16R2.14780 CC1(CCCC1)OCCc2ccccc2 7a_100000751722_100000765856 [0,1,1,0,0,0|1,0,0]=3 1770 B16R2.14780 CC1(CCCC1)OCCc2ccccn2 7a_100000751722_100015183660 [0,1,1,0,0,0|2,0,0]=4 1771 B16R2.14780 CC1(CCCC1)OCCc2cccnc2 7a_100000751722_200011713674 [0,1,1,0,0,0|2,0,0]=4 1772 B16R2.14780 CC1(CCCC1)OCCc2ccncc2 7a_100000751722_100000723409 [0,1,1,0,0,0|2,0,0]=4 1773 B16R2.14780 CC1(CCOC1)NCCc2ccccc2 2230a_100000693475_100000765856 [0,1,1,0,0,0|1,0,0]=3 1774 B16R2.14780 CC1(CCOC1)NCCc2ccccn2 2230a_100000693475_100015183660 [0,1,1,0,0,0|2,0,0]=4 1775 B16R2.14780 CC1(CCOC1)NCCc2cccnc2 2230a_100000693475_200011713674 [0,1,1,0,0,0|2,0,0]=4 1776 B16R2.14780 CC1(CCOC1)NCCc2ccncc2 2230a_100000693475_100000723409 [0,1,1,0,0,0|2,0,0]=4 1777 B16R2.14780 CC1(CCOC1)NCSc2ccccc2 2230a_100000693475_100011218342 [0,1,1,0,0,0|2,0,0]=4 1778 B16R2.14780 NC1(CCCC1)COCc2ccccc2 34a_100000749328_100015291786 [0,1,1,0,0,0|2,0,0]=4 1779 B16R2.14780 OC1(CCCC1)CNCc2ccccc2 207a_100000737848_100015611070 [0,1,1,0,0,0|2,0,0]=4 1780 B16R2.14780 OC1(CCCC1)CNCc2ccccc2 2230a_100000737848_100015291786 [0,1,1,0,0,0|2,0,0]=4 1781 B16R2.14780 OC1(CCCC1)CNCc2ccccc2 270004a_100000737848_100015611070 [0,1,1,0,0,0|2,0,0]=4 1782 B14R1.29 CCCC(=O)CC(C)c1ccccc1 1458a_100000183687_100000210303 [0,0,2,0,0,0|1,0,1]=4 1783 B14R1.29 CCCC(=O)CC(C)c1ccccc1 1458a_100000211992_100000756946 [0,0,2,0,0,0|1,0,1]=4 1784 B14R1.29 CCCC(C)CN(C)c1ccccc1 2230a_100000210012_100011216630 [0,0,2,0,0,0|2,0,0]=4 1785 B14R1.29 CCCC(C)CN(C)c1ccccc1 269982a_100000210012_100011216630 [0,0,2,0,0,0|2,0,0]=4 1786 B14R1.29 CCCC(C)CN(C)c1ccccc1 34a_100000210012_100011216630 [0,0,2,0,0,0|2,0,0]=4 1787 B14R1.29 CCCC(C)NC(C)c1ccccc1 2230a_100000741246_100000230085 [0,0,2,0,0,0|2,0,0]=4 1788 B14R1.29 CCCC(C)NC(C)c1ccccc1 269862a_100000741246_100000185851 [0,0,2,0,0,0|2,0,0]=4 1789 B14R1.29 CCCC(C)N[C@H](C)c1ccccc1 2230a_100000751104_100000766640 [0,0,2,0,0,0|2,0,0]=4 1790 B14R1.29 CCCC(C)N[C@H](C)c1ccccc1 270004a_100000751104_100000211909 [0,0,2,0,0,0|2,0,0]=4 1791 B14R1.29 CCCC(C)OC(C)c1ccccc1 34a_100000764384_100000211855 [0,0,2,0,0,0|2,0,0]=4 1792 B14R1.29 CCCC(C)OC(C)c1ccccc1 7a_100000764384_100000230085 [0,0,2,0,0,0|2,0,0]=4 1793 B14R1.29 CCCC(C)O[C@H](C)c1ccccc1 34a_100000761318_100000766640 [0,0,2,0,0,0|2,0,0]=4 1794 B14R1.29 CCCC(C)O[C@H](C)c1ccccc1 7a_100000761318_100000766640 [0,0,2,0,0,0|2,0,0]=4 1795 B14R1.29 CCCC(C)SC(C)c1ccccc1 62a_100000230085_100000766640 [0,0,2,0,0,0|2,0,0]=4 1796 B14R1.29 CCCC(C)SC(C)c1ccccc1 62a_100000766640_100000230085 [0,0,2,0,0,0|2,0,0]=4 1797 B14R1.29 CCCN(C)CC(C)c1ccccc1 2230a_100000747261_100000756946 [0,0,2,0,0,0|2,0,0]=4 1798 B14R1.29 CCCN(C)CC(C)c1ccccc1 269982a_100000747261_100000756946 [0,0,2,0,0,0|2,0,0]=4 1799 B14R1.29 CCCN(C)CC(C)c1ccccc1 270004a_100000747261_100000212034 [0,0,2,0,0,0|2,0,0]=4 1800 B14R1.38 C#CCCNCC(C)c1ccccc1 2230a_100000701038_100000688953 [0,0,2,0,0,0|0,0,2]=4 1801 B14R1.38 C#CCCNCC(C)c1ccccc1 34a_100000701038_100000688953 [0,0,2,0,0,0|0,0,2]=4 1802 B14R1.38 C#CCCNCC(C)c1ccccc1 34a_100000755551_100000756946 [0,0,2,0,0,0|0,0,2]=4 1803 B14R1.38 C/C=C/CNCC(C)c1ccccc1 34a_100000701038_100102629194 [0,0,2,0,0,0|0,0,2]=4 1804 B14R1.38 C=CCCNCC(C)c1ccccc1 2230a_100000701038_100000754431 [0,0,2,0,0,0|0,0,2]=4 1805 B14R1.38 C=CCCNCC(C)c1ccccc1 2230a_100015191253_100000756946 [0,0,2,0,0,0|0,0,2]=4 1806 B14R1.38 C=CCCNCC(C)c1ccccc1 270004a_100015191253_100000212034 [0,0,2,0,0,0|0,0,2]=4 1807 B14R1.38 C=CCCNCC(C)c1ccccc1 34a_100000701038_100000754431 [0,0,2,0,0,0|0,0,2]=4 1808 B14R1.38 CC#CCNCC(C)c1ccccc1 2230a_100000685387_100000756946 [0,0,2,0,0,0|0,0,2]=4 1809 B14R1.38 CC#CCNCC(C)c1ccccc1 2230a_100000701038_100000748600 [0,0,2,0,0,0|0,0,2]=4 1810 B14R1.38 CC#CCNCC(C)c1ccccc1 34a_100000685387_100000756946 [0,0,2,0,0,0|0,0,2]=4 1811 B14R1.38 CC#CCNCC(C)c1ccccc1 34a_100000701038_100000748600 [0,0,2,0,0,0|0,0,2]=4 1812 B14R1.38 CC(CCNCCO)c1ccccc1 270004a_100000210304_100000189432 [0,0,2,0,0,0|2,0,0]=4 1813 B14R1.38 CC(CNCCC#N)c1ccccc1 2230a_100000701038_100011215226 [0,0,2,0,0,0|1,0,1]=4 1814 B14R1.38 CC(CNCCC#N)c1ccccc1 270004a_100000720768_100000212034 [0,0,2,0,0,0|1,0,1]=4 1815 B14R1.38 CC(CNCCCF)c1ccccc1 2230a_100000701038_100011934791 [0,0,2,0,0,0|1,0,0]=3 1816 B14R1.38 CC(CNCCCF)c1ccccc1 2230a_100015189416_100000756946 [0,0,2,0,0,0|1,0,0]=3 1817 B14R1.38 CC(CNCCCF)c1ccccc1 270004a_100015189416_100000212034 [0,0,2,0,0,0|1,0,0]=3 1818 B14R1.38 CC(CNCCCF)c1ccccc1 34a_100000701038_100011934791 [0,0,2,0,0,0|1,0,0]=3 1819 B14R1.38 CC(CNCCCF)c1ccccc1 34a_100015189416_100000756946 [0,0,2,0,0,0|1,0,0]=3 1820 B14R1.38 CC(CNCCCO)c1ccccc1 2230a_100000701038_100000230001 [0,0,2,0,0,0|1,0,0]=3 1821 B14R1.38 CC(CNCCCO)c1ccccc1 270004a_100000182051_100000212034 [0,0,2,0,0,0|1,0,0]=3 1822 B14R1.38 CC(CNCCCO)c1ccccc1 34a_100000701038_100000230001 [0,0,2,0,0,0|1,0,0]=3 1823 B14R1.38 CC(COCCCBr)c1ccccc1 34a_100011217188_100000756946 [0,0,2,0,0,0|2,0,0]=4 1824 B14R1.38 CC(COCCCCl)c1ccccc1 34a_100000230001_100000756946 [0,0,2,0,0,0|2,0,0]=4 1825 B14R1.38 CC(COCCCF)c1ccccc1 34a_100000759539_100000756946 [0,0,2,0,0,0|2,0,0]=4 1826 B14R1.38 CC(COCCCF)c1ccccc1 34a_100011215166_100011934791 [0,0,2,0,0,0|2,0,0]=4 1827 B14R1.38 CC(COCCCF)c1ccccc1 7a_100011215166_100011934791 [0,0,2,0,0,0|2,0,0]=4 1828 B14R1.38 CC(COCCCN)c1ccccc1 34a_100000182051_100000756946 [0,0,2,0,0,0|1,0,0]=3 1829 B14R1.38 CC(COCCCO)c1ccccc1 34a_100011215166_100000230001 [0,0,2,0,0,0|2,0,0]=4 1830 B14R1.38 CC(COCCCO)c1ccccc1 7a_100011215166_100011215043 [0,0,2,0,0,0|2,0,0]=4 1831 B14R1.38 CC(COCCON)c1ccccc1 34a_100000700252_100000756946 [0,0,2,0,0,0|2,0,0]=4 1832 B14R1.38 CC(CSCCCF)c1ccccc1 62a_100000756946_100011934791 [0,0,2,0,0,0|2,0,0]=4 1833 B14R1.38 CC(CSCCCF)c1ccccc1 62a_100011934791_100000756946 [0,0,2,0,0,0|2,0,0]=4 1834 B14R1.38 CC(CSCCCO)c1ccccc1 62a_100000756946_100011215043 [0,0,2,0,0,0|2,0,0]=4 1835 B14R1.38 CC(CSCCCO)c1ccccc1 62a_100011215043_100000756946 [0,0,2,0,0,0|2,0,0]=4 1836 B14R1.38 CC(NCCCCO)c1ccccc1 2230a_100000750430_100000230085 [0,0,2,0,0,0|2,0,0]=4 1837 B14R1.38 CC(NCCCCO)c1ccccc1 269862a_100000750430_100000185851 [0,0,2,0,0,0|2,0,0]=4 1838 B14R1.38 CC(NCCCCO)c1ccccc1 34a_100000750430_100000211855 [0,0,2,0,0,0|2,0,0]=4 1839 B14R1.38 CC(OCCCCBr)c1ccccc1 34a_100011216708_100000211855 [0,0,2,0,0,0|2,0,0]=4 1840 B14R1.38 CC(OCCCCCl)c1ccccc1 34a_100000210776_100000211855 [0,0,2,0,0,0|2,0,0]=4 1841 B14R1.38 CC(OCCCCCl)c1ccccc1 7a_100000210776_100000230085 [0,0,2,0,0,0|2,0,0]=4 1842 B14R1.38 CC(OCCCCF)c1ccccc1 34a_100011995726_100000211855 [0,0,2,0,0,0|2,0,0]=4 1843 B14R1.38 CC(OCCCCF)c1ccccc1 7a_100011995726_100000230085 [0,0,2,0,0,0|2,0,0]=4 1844 B14R1.38 CC(OCCCCI)c1ccccc1 34a_200012148704_100000211855 [0,0,2,0,0,0|2,0,0]=4 1845 B14R1.38 CC(OCCCCN)c1ccccc1 34a_100000750430_100000211855 [0,0,2,0,0,0|1,0,0]=3 1846 B14R1.38 CC(SCCCCF)c1ccccc1 62a_100000230085_100000729493 [0,0,2,0,0,0|2,0,0]=4 1847 B14R1.38 CC(SCCCCF)c1ccccc1 62a_100000729493_100000230085 [0,0,2,0,0,0|2,0,0]=4 1848 B14R1.38 CC(SCCCCO)c1ccccc1 62a_100000210776_100000230085 [0,0,2,0,0,0|2,0,0]=4 1849 B14R1.38 CC(SCCCCO)c1ccccc1 62a_100000230085_100000210776 [0,0,2,0,0,0|2,0,0]=4 1850 B14R1.38 CC=CCNCC(C)c1ccccc1 2230a_100000701038_100000070051 [0,0,2,0,0,0|0,0,2]=4 1851 B14R1.38 CC=CCNCC(C)c1ccccc1 34a_100000701038_100000070051 [0,0,2,0,0,0|0,0,2]=4 1852 B14R1.38 CCCCCCN(C)c1ccccc1 2230a_100000210012_100000210314 [0,0,2,0,0,0|2,0,0]=4 1853 B14R1.38 CCCCCCN(C)c1ccccc1 2230a_200000219565_200000210301 [0,0,2,0,0,0|2,0,0]=4 1854 B14R1.38 CCCCCCN(C)c1ccccc1 269982a_100000210012_100000210757 [0,0,2,0,0,0|2,0,0]=4 1855 B14R1.38 CCCCCCN(C)c1ccccc1 269982a_200000219565_200000210301 [0,0,2,0,0,0|2,0,0]=4 1856 B14R1.38 CCCCCCN(C)c1ccccc1 34a_100000210012_100000210314 [0,0,2,0,0,0|2,0,0]=4 1857 B14R1.38 CCCCCCN(C)c1ccccc1 34a_200000219565_200000210301 [0,0,2,0,0,0|2,0,0]=4 1858 B14R1.38 CCCCCCN(C)c1ccccc1 7a_200000219565_200000210301 [0,0,2,0,0,0|2,0,0]=4 1859 B14R1.38 CCCCCCN([13CH3])c1ccccc1 2230a_200000219565_200025704644 [0,0,2,0,0,0|2,0,0]=4 1860 B14R1.38 CCCCCCN([13CH3])c1ccccc1 269982a_200000219565_200025704644 [0,0,2,0,0,0|2,0,0]=4 1861 B14R1.38 CCCCCCN([13CH3])c1ccccc1 34a_200000219565_200025704644 [0,0,2,0,0,0|2,0,0]=4 1862 B14R1.38 CCCCCCN([13CH3])c1ccccc1 7a_200000219565_200025704644 [0,0,2,0,0,0|2,0,0]=4 1863 B14R1.38 CCCCCNC(C)c1ccccc1 2230a_100000209983_100000230085 [0,0,2,0,0,0|2,0,0]=4 1864 B14R1.38 CCCCCNC(C)c1ccccc1 269862a_100000209983_100000185851 [0,0,2,0,0,0|2,0,0]=4 1865 B14R1.38 CCCCCN[C@H](C)c1ccccc1 2230a_100000751104_100000210326 [0,0,2,0,0,0|2,0,0]=4 1866 B14R1.38 CCCCCOC(C)c1ccccc1 34a_100000210253_100000211855 [0,0,2,0,0,0|2,0,0]=4 1867 B14R1.38 CCCCCOC(C)c1ccccc1 7a_100000210253_100000230085 [0,0,2,0,0,0|2,0,0]=4 1868 B14R1.38 CCCCCO[C@H](C)c1ccccc1 34a_100000761318_100000718602 [0,0,2,0,0,0|2,0,0]=4 1869 B14R1.38 CCCCCO[C@H](C)c1ccccc1 7a_100000761318_100000210326 [0,0,2,0,0,0|2,0,0]=4 1870 B14R1.38 CCCCCSC(C)c1ccccc1 62a_100000210326_100000230085 [0,0,2,0,0,0|2,0,0]=4 1871 B14R1.38 CCCCCSC(C)c1ccccc1 62a_100000230085_100000210326 [0,0,2,0,0,0|2,0,0]=4 1872 B14R1.38 CCCCNCC(=O)c1ccccc1 7a_106832991798_100000211460 [0,0,2,0,0,0|1,0,1]=4 1873 B14R1.38 CCCCNCC(C)c1ccccc1 2230a_100000102301_100000756946 [0,0,2,0,0,0|0,0,0]=2 1874 B14R1.38 CCCCNCC(C)c1ccccc1 2230a_100000701038_100000210211 [0,0,2,0,0,0|0,0,0]=2 1875 B14R1.38 CCCCNCC(C)c1ccccc1 270004a_100000102301_100000212034 [0,0,2,0,0,0|0,0,0]=2 1876 B14R1.38 CCCCNCC(C)c1ccccc1 34a_100000701038_100000210210 [0,0,2,0,0,0|0,0,0]=2 1877 B14R1.38 CCCCNCC(C)c1ccccc1 7a_106832991798_100000756946 [0,0,2,0,0,0|0,0,0]=2 1878 B14R1.38 CCCCNCC(O)c1ccccc1 2230a_100000102301_100000185958 [0,0,2,0,0,0|1,0,0]=3 1879 B14R1.38 CCCCNCC(O)c1ccccc1 2230a_100000210709_100000210211 [0,0,2,0,0,0|1,0,0]=3 1880 B14R1.38 CCCCNCC(O)c1ccccc1 7a_106832991798_100000185958 [0,0,2,0,0,0|1,0,0]=3 1881 B14R1.38 CCCCNCC(O)c1ccccn1 2230a_100000691469_100000210211 [0,0,2,0,0,0|2,0,0]=4 1882 B14R1.38 CCCCNCC(O)c1cccnc1 2230a_100020605170_100000210211 [0,0,2,0,0,0|2,0,0]=4 1883 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 2230a_100000102301_100011933945 [0,0,2,0,0,0|1,0,0]=3 1884 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 7a_106832991798_100011933945 [0,0,2,0,0,0|1,0,0]=3 1885 B14R1.38 CCCCNN=C(C)c1ccccc1 4a_100025702795_100000185851 [0,0,2,0,0,0|1,0,1]=4 1886 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100000210227_100000756946 [0,0,2,0,0,0|1,0,0]=3 1887 B14R1.38 CCCCOCC(C)c1ccccc1 34a_100011215166_100000210210 [0,0,2,0,0,0|1,0,0]=3 1888 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100000210227_100000756946 [0,0,2,0,0,0|1,0,0]=3 1889 B14R1.38 CCCCOCC(C)c1ccccc1 7a_100011215166_100000210211 [0,0,2,0,0,0|1,0,0]=3 1890 B14R1.38 CCCCOCC(O)c1ccccc1 34a_100000210227_100000185958 [0,0,2,0,0,0|2,0,0]=4 1891 B14R1.38 CCCCOCC(O)c1ccccc1 7a_100000210227_100000185958 [0,0,2,0,0,0|2,0,0]=4 1892 B14R1.38 CCCCOCN(C)c1ccccc1 2230a_100000210012_100011995733 [0,0,2,0,0,0|2,0,0]=4 1893 B14R1.38 CCCCOCN(C)c1ccccc1 269982a_100000210012_100011995733 [0,0,2,0,0,0|2,0,0]=4 1894 B14R1.38 CCCCOCN(C)c1ccccc1 34a_100000210012_100011995733 [0,0,2,0,0,0|2,0,0]=4 1895 B14R1.38 CCCCOC[C@@H](N)c1ccccc1 34a_100000751927_100000210210 [0,0,2,0,0,0|2,0,0]=4 1896 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 34a_100000210227_100011933945 [0,0,2,0,0,0|2,0,0]=4 1897 B14R1.38 CCCCOC[C@@H](O)c1ccccc1 7a_100000210227_100011933945 [0,0,2,0,0,0|2,0,0]=4 1898 B14R1.38 CCCCSCC(C)c1ccccc1 62a_100000210211_100000756946 [0,0,2,0,0,0|1,0,0]=3 1899 B14R1.38 CCCCSCC(C)c1ccccc1 62a_100000756946_100000210210 [0,0,2,0,0,0|1,0,0]=3 1900 B14R1.38 CCCCSCC(O)c1ccccc1 62a_100000185958_100000210210 [0,0,2,0,0,0|2,0,0]=4 1901 B14R1.38 CCCCSCC(O)c1ccccc1 62a_100000210211_100000185958 [0,0,2,0,0,0|2,0,0]=4 1902 B14R1.38 CCCCSC[C@@H](O)c1ccccc1 62a_100000210211_100011933945 [0,0,2,0,0,0|2,0,0]=4 1903 B14R1.38 CCCCSC[C@@H](O)c1ccccc1 62a_100011933945_100000210210 [0,0,2,0,0,0|2,0,0]=4 1904 B14R1.38 CCCNCCC(C)c1ccccc1 270004a_100020643023_100000189432 [0,0,2,0,0,0|2,0,0]=4 1905 B14R1.38 CCOCSCC(C)c1ccccc1 62a_100000739092_100000756946 [0,0,2,0,0,0|2,0,0]=4 1906 B14R1.38 CCOCSCC(C)c1ccccc1 62a_100000756946_100000739092 [0,0,2,0,0,0|2,0,0]=4 1907 B14R1.38 CN(CCCCCF)c1ccccc1 2230a_100000210012_100000729378 [0,0,2,0,0,0|2,0,0]=4 1908 B14R1.38 CN(CCCCCF)c1ccccc1 269982a_100000210012_100000729378 [0,0,2,0,0,0|2,0,0]=4 1909 B14R1.38 CN(CCCCCF)c1ccccc1 34a_100000210012_100000729378 [0,0,2,0,0,0|2,0,0]=4 1910 B14R1.38 CN(CCCCCO)c1ccccc1 2230a_100000210012_100000746330 [0,0,2,0,0,0|2,0,0]=4 1911 B14R1.38 CN(CCCCCO)c1ccccc1 269982a_100000210012_100000746330 [0,0,2,0,0,0|2,0,0]=4 1912 B14R1.38 CN(CCCCCO)c1ccccc1 34a_100000210012_100000746330 [0,0,2,0,0,0|2,0,0]=4 1913 B14R1.38 COCCNCC(C)c1ccccc1 2230a_100000209980_100000756946 [0,0,2,0,0,0|1,0,0]=3 1914 B14R1.38 COCCNCC(C)c1ccccc1 2230a_100000701038_100011201679 [0,0,2,0,0,0|1,0,0]=3 1915 B14R1.38 COCCNCC(C)c1ccccc1 270004a_100000209980_100000212034 [0,0,2,0,0,0|1,0,0]=3 1916 B14R1.38 COCCNCC(C)c1ccccc1 34a_100000701038_100011201679 [0,0,2,0,0,0|1,0,0]=3 1917 B14R1.38 COCCNCC(O)c1ccccc1 2230a_100000209980_100000185958 [0,0,2,0,0,0|2,0,0]=4 1918 B14R1.38 COCCNCC(O)c1ccccc1 2230a_100000210709_100011201679 [0,0,2,0,0,0|2,0,0]=4 1919 B14R1.38 COCCNC[C@@H](O)c1ccccc1 2230a_100000209980_100011933945 [0,0,2,0,0,0|2,0,0]=4 1920 B14R1.38 COCCOCC(C)c1ccccc1 34a_100000210237_100000756946 [0,0,2,0,0,0|2,0,0]=4 1921 B14R1.38 COCCOCC(C)c1ccccc1 34a_100011215166_100011201679 [0,0,2,0,0,0|2,0,0]=4 1922 B14R1.38 COCCOCC(C)c1ccccc1 7a_100011215166_100000233755 [0,0,2,0,0,0|2,0,0]=4 1923 B14R1.38 COCCSCC(C)c1ccccc1 62a_100000233755_100000756946 [0,0,2,0,0,0|2,0,0]=4 1924 B14R1.38 COCCSCC(C)c1ccccc1 62a_100000756946_100000233755 [0,0,2,0,0,0|2,0,0]=4 1925 B14R1.38 CSCCNCC(C)c1ccccc1 2230a_100000701038_100000751147 [0,0,2,0,0,0|1,0,0]=3 1926 B14R1.38 CSCCNCC(C)c1ccccc1 2230a_100020590264_100000756946 [0,0,2,0,0,0|1,0,0]=3 1927 B14R1.38 CSCCNCC(C)c1ccccc1 270004a_100020590264_100000212034 [0,0,2,0,0,0|1,0,0]=3 1928 B14R1.38 CSCCNCC(C)c1ccccc1 34a_100000701038_100000212216 [0,0,2,0,0,0|1,0,0]=3 1929 B14R1.38 CSCCNCC(O)c1ccccc1 2230a_100000210709_100000751147 [0,0,2,0,0,0|2,0,0]=4 1930 B14R1.38 CSCCNCC(O)c1ccccc1 2230a_100020590264_100000185958 [0,0,2,0,0,0|2,0,0]=4 1931 B14R1.38 CSCCNC[C@@H](O)c1ccccc1 2230a_100020590264_100011933945 [0,0,2,0,0,0|2,0,0]=4 1932 B14R1.38 CSCCOCC(C)c1ccccc1 34a_100000230434_100000756946 [0,0,2,0,0,0|2,0,0]=4 1933 B14R1.38 CSCCOCC(C)c1ccccc1 34a_100011215166_100000212216 [0,0,2,0,0,0|2,0,0]=4 1934 B14R1.38 CSCCOCC(C)c1ccccc1 7a_100000230434_100000756946 [0,0,2,0,0,0|2,0,0]=4 1935 B14R1.38 CSCCOCC(C)c1ccccc1 7a_100011215166_100000212216 [0,0,2,0,0,0|2,0,0]=4 1936 B14R1.38 CSCCSCC(C)c1ccccc1 62a_100000212216_100000756946 [0,0,2,0,0,0|2,0,0]=4 1937 B14R1.38 CSCCSCC(C)c1ccccc1 62a_100000756946_100000751147 [0,0,2,0,0,0|2,0,0]=4 1938 B14R1.38 C[C@@H](NCCCCF)c1ccccc1 2230a_100000751104_100000729493 [0,0,2,0,0,0|2,0,0]=4 1939 B14R1.38 C[C@@H](NCCCCO)c1ccccc1 2230a_100000751104_100000210776 [0,0,2,0,0,0|2,0,0]=4 1940 B14R1.38 C[C@@H](OCCCCF)c1ccccc1 34a_100000761318_100000729493 [0,0,2,0,0,0|2,0,0]=4 1941 B14R1.38 C[C@@H](OCCCCF)c1ccccc1 7a_100000761318_100000729493 [0,0,2,0,0,0|2,0,0]=4 1942 B14R1.38 C[C@@H](OCCCCO)c1ccccc1 34a_100000761318_100011216708 [0,0,2,0,0,0|2,0,0]=4 1943 B14R1.38 C[C@@H](OCCCCO)c1ccccc1 7a_100000761318_100000210776 [0,0,2,0,0,0|2,0,0]=4 1944 B14R1.38 NCCCOCC(O)c1ccccc1 34a_100000182051_100000185958 [0,0,2,0,0,0|2,0,0]=4 1945 B14R1.38 NCCCOC[C@@H](O)c1ccccc1 34a_100000182051_100011933945 [0,0,2,0,0,0|2,0,0]=4 1946 B14R1.38 NCCOCC[C@@H](O)c1ccccc1 34a_100000210304_100000729684 [0,0,2,0,0,0|2,0,0]=4 1947 B14R1.38 OC(CNCCCF)c1ccccc1 2230a_100000210709_100011934791 [0,0,2,0,0,0|2,0,0]=4 1948 B14R1.38 OC(CNCCCF)c1ccccc1 2230a_100015189416_100000185958 [0,0,2,0,0,0|2,0,0]=4 1949 B14R1.38 OC(CNCCCF)c1ccccc1 34a_100015189416_100000185958 [0,0,2,0,0,0|2,0,0]=4 1950 B14R1.38 OCCCNCC(O)c1ccccc1 2230a_100000210709_100000230001 [0,0,2,0,0,0|2,0,0]=4 1951 B14R1.38 O[C@H](CNCCCF)c1ccccc1 2230a_100015189416_100011933945 [0,0,2,0,0,0|2,0,0]=4 1952 B14R1.38 O[C@H](CNCCCF)c1ccccc1 34a_100015189416_100011933945 [0,0,2,0,0,0|2,0,0]=4 1953 B14R1.121 C=CCNCC(CC)c1ccccc1 270004a_100020586998_100000753018 [0,0,2,0,0,0|0,0,2]=4 1954 B14R1.121 CCC(CNCCO)c1ccccc1 270004a_100000210304_100000753018 [0,0,2,0,0,0|1,0,0]=3 1955 B14R1.121 CCC(COCCF)c1ccccc1 34a_100000752371_100011217306 [0,0,2,0,0,0|2,0,0]=4 1956 B14R1.121 CCC(COCCF)c1ccccc1 7a_100000752371_100011217306 [0,0,2,0,0,0|2,0,0]=4 1957 B14R1.121 CCC(COCCO)c1ccccc1 34a_100000752371_100000211926 [0,0,2,0,0,0|2,0,0]=4 1958 B14R1.121 CCC(COCCO)c1ccccc1 7a_100000752371_100000211926 [0,0,2,0,0,0|2,0,0]=4 1959 B14R1.121 CCC(COCSC)c1ccccc1 34a_100000752371_100011218213 [0,0,2,0,0,0|2,0,0]=4 1960 B14R1.121 CCCCCC(NC)c1ccccc1 269862a_106832991636_100000211787 [0,0,2,0,0,0|2,0,0]=4 1961 B14R1.121 CCCCCC(OC)c1ccccc1 34a_100000748122_200000210301 [0,0,2,0,0,0|2,0,0]=4 1962 B14R1.121 CCCCCC(OC)c1ccccc1 7a_100000748122_200000210301 [0,0,2,0,0,0|2,0,0]=4 1963 B14R1.121 CCCCCC(O[13CH3])c1ccccc1 34a_100000748122_200025704644 [0,0,2,0,0,0|2,0,0]=4 1964 B14R1.121 CCCCCC(O[13CH3])c1ccccc1 7a_100000748122_200025704644 [0,0,2,0,0,0|2,0,0]=4 1965 B14R1.121 CCCCCN(CC)c1ccccc1 2230a_100000210013_100000210326 [0,0,2,0,0,0|2,0,0]=4 1966 B14R1.121 CCCCCN(CC)c1ccccc1 2230a_200000219563_100000210202 [0,0,2,0,0,0|2,0,0]=4 1967 B14R1.121 CCCCCN(CC)c1ccccc1 269982a_100000210013_100000210215 [0,0,2,0,0,0|2,0,0]=4 1968 B14R1.121 CCCCCN(CC)c1ccccc1 269982a_200000219563_100000204670 [0,0,2,0,0,0|2,0,0]=4 1969 B14R1.121 CCCCCN(CC)c1ccccc1 34a_100000210013_100000718602 [0,0,2,0,0,0|2,0,0]=4 1970 B14R1.121 CCCCCN(CC)c1ccccc1 34a_200000219563_100000210202 [0,0,2,0,0,0|2,0,0]=4 1971 B14R1.121 CCCCCN(CC)c1ccccc1 7a_200000219563_100000210202 [0,0,2,0,0,0|2,0,0]=4 1972 B14R1.121 CCCCCN(CF)c1ccccc1 269982a_200000219563_100015361967 [0,0,2,0,0,0|2,0,0]=4 1973 B14R1.121 CCCCCN(CF)c1ccccc1 34a_200000219563_100015361967 [0,0,2,0,0,0|2,0,0]=4 1974 B14R1.121 CCCCCN(CF)c1ccccc1 7a_200000219563_100015361967 [0,0,2,0,0,0|2,0,0]=4 1975 B14R1.121 CCCCNC(CC)c1ccccc1 2230a_100000737752_100000210211 [0,0,2,0,0,0|2,0,0]=4 1976 B14R1.121 CCCCNC(CC)c1ccccc1 269862a_100000102301_100000210124 [0,0,2,0,0,0|2,0,0]=4 1977 B14R1.121 CCCCN[C@H](CO)c1ccccc1 2230a_100000751927_100000210211 [0,0,2,0,0,0|2,0,0]=4 1978 B14R1.121 CCCCN[C@H](CO)c1ccccc1 34a_100000751927_100000210210 [0,0,2,0,0,0|2,0,0]=4 1979 B14R1.121 CCCCOC(CBr)c1ccccc1 7a_100000185958_100000210211 [0,0,2,0,0,0|2,0,0]=4 1980 B14R1.121 CCCCOC(CC)c1ccccc1 34a_100000698172_100000210210 [0,0,2,0,0,0|2,0,0]=4 1981 B14R1.121 CCCCOC(CC)c1ccccc1 7a_100000698172_100000210211 [0,0,2,0,0,0|2,0,0]=4 1982 B14R1.121 CCCCOC(CN)c1ccccc1 34a_100000210709_100000210210 [0,0,2,0,0,0|1,0,0]=3 1983 B14R1.121 CCCCO[C@H](CCl)c1ccccc1 34a_100011933945_100000210210 [0,0,2,0,0,0|2,0,0]=4 1984 B14R1.121 CCCCO[C@H](CCl)c1ccccc1 7a_100011933945_100000210211 [0,0,2,0,0,0|2,0,0]=4 1985 B14R1.121 CCCNCC(CC)c1ccccc1 270004a_100020643023_100000753018 [0,0,2,0,0,0|0,0,0]=2 1986 B14R1.121 CCCNN=C(CC)c1ccccc1 4a_100000740057_100000210124 [0,0,2,0,0,0|1,0,1]=4 1987 B14R1.121 CCCOCC(CC)c1ccccc1 34a_100000752371_100000210303 [0,0,2,0,0,0|1,0,0]=3 1988 B14R1.121 CCCOCC(CC)c1ccccc1 7a_100000752371_100000210303 [0,0,2,0,0,0|1,0,0]=3 1989 B14R1.121 CCCOCC(OC)c1ccccc1 34a_100011215540_100000210303 [0,0,2,0,0,0|2,0,0]=4 1990 B14R1.121 CCCOCC(OC)c1ccccc1 7a_100011215540_100000210303 [0,0,2,0,0,0|2,0,0]=4 1991 B14R1.121 COCCOC(CN)c1ccccc1 34a_100000210709_100011201679 [0,0,2,0,0,0|2,0,0]=4 1992 B14R1.121 CSCCOC(CN)c1ccccc1 34a_100000210709_100000212216 [0,0,2,0,0,0|2,0,0]=4 1993 B14R1.121 NCC(OCCCF)c1ccccc1 34a_100000210709_100011934791 [0,0,2,0,0,0|2,0,0]=4 1994 B14R1.121 NCC(OCCCO)c1ccccc1 34a_100000210709_100000230001 [0,0,2,0,0,0|2,0,0]=4 1995 B14R1.520 CC(CC#N)NCCc1ccccc1 2230a_100000106460_100009813641 [0,0,2,0,0,0|1,0,1]=4 1996 B14R1.520 CC(CCBr)OCCc1ccccc1 34a_100012276601_100000765856 [0,0,2,0,0,0|2,0,0]=4 1997 B14R1.520 CC(CCO)NCCc1ccccc1 2230a_100000106460_100009893172 [0,0,2,0,0,0|1,0,0]=3 1998 B14R1.520 CC(CCO)NCCc1ccccc1 34a_100000106460_100009893172 [0,0,2,0,0,0|1,0,0]=3 1999 B14R1.520 CC(CCO)NCCc1cccnc1 2230a_100000736294_100009893172 [0,0,2,0,0,0|2,0,0]=4 2000 B14R1.520 CC(CCO)OCCc1ccccc1 34a_100000210268_100009893172 [0,0,2,0,0,0|2,0,0]=4 2001 B14R1.520 CC(CCO)OCCc1ccccc1 7a_100000210268_100009893172 [0,0,2,0,0,0|2,0,0]=4 2002 B14R1.520 CC(CCO)SCCc1ccccc1 62a_100000765856_100009893172 [0,0,2,0,0,0|2,0,0]=4 2003 B14R1.520 CC(CCO)SCCc1ccccc1 62a_100009893172_100011218657 [0,0,2,0,0,0|2,0,0]=4 2004 B14R1.520 CCCC(=O)NCCc1ccccc1 11a_100000106460_100000211992 [0,0,2,0,0,0|1,0,1]=4 2005 B14R1.520 CCCC(=O)NCCc1ccccc1 1626a_100000106460_100000211992 [0,0,2,0,0,0|1,0,1]=4 2006 B14R1.520 CCCC(=O)NCCc1ccccc1 240690a_100000106460_100000211992 [0,0,2,0,0,0|1,0,1]=4 2007 B14R1.520 CCCC(=O)NCCc1ccccc1 527a_100000106460_100000211992 [0,0,2,0,0,0|1,0,1]=4 2008 B14R1.520 CCCC(C)CNCc1ccccc1 2230a_100015324214_100011216630 [0,0,2,0,0,0|2,0,0]=4 2009 B14R1.520 CCCC(C)CNCc1ccccc1 270004a_100015324214_100000243154 [0,0,2,0,0,0|2,0,0]=4 2010 B14R1.520 CCCC(C)CNCc1ccccc1 34a_100015324214_100011216630 [0,0,2,0,0,0|2,0,0]=4 2011 B14R1.520 CCCC(C)COCc1ccccc1 34a_100000210790_100011216630 [0,0,2,0,0,0|2,0,0]=4 2012 B14R1.520 CCCC(C)COCc1ccccc1 34a_100000688023_100015291786 [0,0,2,0,0,0|2,0,0]=4 2013 B14R1.520 CCCC(C)COCc1ccccc1 7a_100000210790_100011216630 [0,0,2,0,0,0|2,0,0]=4 2014 B14R1.520 CCCC(C)COCc1ccccc1 7a_100000688023_100000211182 [0,0,2,0,0,0|2,0,0]=4 2015 B14R1.520 CCCC(C)CSCc1ccccc1 62a_100000211182_100011216630 [0,0,2,0,0,0|2,0,0]=4 2016 B14R1.520 CCCC(C)CSCc1ccccc1 62a_100011216630_100015291786 [0,0,2,0,0,0|2,0,0]=4 2017 B14R1.520 CCCC(C)NCCc1ccccc1 2230a_100000106460_100000766640 [0,0,2,0,0,0|0,0,0]=2 2018 B14R1.520 CCCC(C)NCCc1ccccc1 2230a_100000741246_100000765856 [0,0,2,0,0,0|0,0,0]=2 2019 B14R1.520 CCCC(C)NCCc1ccccc1 270004a_100000106460_100000211909 [0,0,2,0,0,0|0,0,0]=2 2020 B14R1.520 CCCC(C)NCCc1ccccc1 34a_100000106460_100000766640 [0,0,2,0,0,0|0,0,0]=2 2021 B14R1.520 CCCC(C)NCCc1ccccn1 2230a_100000741246_100015183660 [0,0,2,0,0,0|1,0,0]=3 2022 B14R1.520 CCCC(C)NCCc1ccccn1 270004a_100000211156_100000211909 [0,0,2,0,0,0|1,0,0]=3 2023 B14R1.520 CCCC(C)NCCc1cccnc1 2230a_100000736294_100000766640 [0,0,2,0,0,0|1,0,0]=3 2024 B14R1.520 CCCC(C)NCCc1cccnc1 2230a_100000741246_200011713674 [0,0,2,0,0,0|1,0,0]=3 2025 B14R1.520 CCCC(C)NCCc1cccnc1 270004a_100000736294_100000211909 [0,0,2,0,0,0|1,0,0]=3 2026 B14R1.520 CCCC(C)NCCc1ccncc1 2230a_100000741246_100000723409 [0,0,2,0,0,0|1,0,0]=3 2027 B14R1.520 CCCC(C)NCCc1ccncc1 270004a_100000742849_100000211909 [0,0,2,0,0,0|1,0,0]=3 2028 B14R1.520 CCCC(C)NCCc1cnccn1 270004a_100000723456_100000211909 [0,0,2,0,0,0|2,0,0]=4 2029 B14R1.520 CCCC(C)NCSc1ccccc1 2230a_100000741246_100011218342 [0,0,2,0,0,0|1,0,0]=3 2030 B14R1.520 CCCC(C)OCCc1ccccc1 34a_100000210268_100000766640 [0,0,2,0,0,0|1,0,0]=3 2031 B14R1.520 CCCC(C)OCCc1ccccc1 34a_100000764384_100000765856 [0,0,2,0,0,0|1,0,0]=3 2032 B14R1.520 CCCC(C)OCCc1ccccc1 7a_100000210268_100000766640 [0,0,2,0,0,0|1,0,0]=3 2033 B14R1.520 CCCC(C)OCCc1ccccc1 7a_100000764384_100000765856 [0,0,2,0,0,0|1,0,0]=3 2034 B14R1.520 CCCC(C)OCCc1ccccn1 34a_100000210271_100000766640 [0,0,2,0,0,0|2,0,0]=4 2035 B14R1.520 CCCC(C)OCCc1ccccn1 7a_100000764384_100015183660 [0,0,2,0,0,0|2,0,0]=4 2036 B14R1.520 CCCC(C)OCCc1cccnc1 34a_100011217484_100000766640 [0,0,2,0,0,0|2,0,0]=4 2037 B14R1.520 CCCC(C)OCCc1cccnc1 7a_100000764384_200011713674 [0,0,2,0,0,0|2,0,0]=4 2038 B14R1.520 CCCC(C)OCCc1ccncc1 34a_100011216225_100000766640 [0,0,2,0,0,0|2,0,0]=4 2039 B14R1.520 CCCC(C)OCCc1ccncc1 7a_100000764384_100000723409 [0,0,2,0,0,0|2,0,0]=4 2040 B14R1.520 CCCC(C)SCCc1ccccc1 62a_100000765856_100000766640 [0,0,2,0,0,0|1,0,0]=3 2041 B14R1.520 CCCC(C)SCCc1ccccc1 62a_100000766640_100011218657 [0,0,2,0,0,0|1,0,0]=3 2042 B14R1.520 CCCC(C)SCCc1ccccn1 62a_100000766640_100015183660 [0,0,2,0,0,0|2,0,0]=4 2043 B14R1.520 CCCC(C)SCCc1ccccn1 62a_100015183660_100000766640 [0,0,2,0,0,0|2,0,0]=4 2044 B14R1.520 CCCC(C)SCCc1cccnc1 62a_100000766640_200011713674 [0,0,2,0,0,0|2,0,0]=4 2045 B14R1.520 CCCC(C)SCCc1cccnc1 62a_200011713674_100000766640 [0,0,2,0,0,0|2,0,0]=4 2046 B14R1.520 CCCC(C)SCCc1ccncc1 62a_100000723409_100000766640 [0,0,2,0,0,0|2,0,0]=4 2047 B14R1.520 CCCC(C)SCCc1ccncc1 62a_100000766640_100000723409 [0,0,2,0,0,0|2,0,0]=4 2048 B14R1.520 CCCC(C)SCSc1ccccc1 62a_100000766640_100011218342 [0,0,2,0,0,0|2,0,0]=4 2049 B14R1.520 CCCC(C)SCSc1ccccc1 62a_100011218342_100000766640 [0,0,2,0,0,0|2,0,0]=4 2050 B14R1.520 CCCN(C)CCCc1ccccc1 2230a_100000693637_100000210303 [0,0,2,0,0,0|2,0,0]=4 2051 B14R1.520 CCCN(C)CCCc1ccccc1 2230a_100000747261_100000211621 [0,0,2,0,0,0|2,0,0]=4 2052 B14R1.520 CCCN(C)CCCc1ccccc1 269982a_100000693637_100000210303 [0,0,2,0,0,0|2,0,0]=4 2053 B14R1.520 CCCN(C)CCCc1ccccc1 269982a_100000747261_100000211621 [0,0,2,0,0,0|2,0,0]=4 2054 B14R1.520 CCNC(C)CCCc1ccccc1 2230a_100015525214_200010759516 [0,0,2,0,0,0|2,0,0]=4 2055 B14R1.520 CCOC(C)CCCc1ccccc1 34a_100121572206_200010759516 [0,0,2,0,0,0|2,0,0]=4 2056 B14R1.520 CCSC(C)CCCc1ccccc1 62a_100000210202_200010759516 [0,0,2,0,0,0|2,0,0]=4 2057 B14R1.520 CCSC(C)CCCc1ccccc1 62a_200010759516_100000210202 [0,0,2,0,0,0|2,0,0]=4 2058 B14R1.520 COCC(C)NCCc1ccccc1 2230a_100000106460_100000765312 [0,0,2,0,0,0|1,0,0]=3 2059 B14R1.520 COCC(C)NCCc1ccccc1 270004a_100000106460_100000749346 [0,0,2,0,0,0|1,0,0]=3 2060 B14R1.520 COCC(C)NCCc1ccccc1 34a_100000106460_100000765312 [0,0,2,0,0,0|1,0,0]=3 2061 B14R1.520 COCC(C)NCCc1ccccn1 270004a_100000211156_100000749346 [0,0,2,0,0,0|2,0,0]=4 2062 B14R1.520 COCC(C)NCCc1cccnc1 2230a_100000736294_100000765312 [0,0,2,0,0,0|2,0,0]=4 2063 B14R1.520 COCC(C)NCCc1cccnc1 270004a_100000736294_100000749346 [0,0,2,0,0,0|2,0,0]=4 2064 B14R1.520 COCC(C)NCCc1ccncc1 270004a_100000742849_100000749346 [0,0,2,0,0,0|2,0,0]=4 2065 B14R1.520 COCC(C)OCCc1ccccc1 34a_100000210268_100000765312 [0,0,2,0,0,0|2,0,0]=4 2066 B14R1.520 COCC(C)OCCc1ccccc1 7a_100000210268_100000765312 [0,0,2,0,0,0|2,0,0]=4 2067 B14R1.520 COCC(C)SCCc1ccccc1 62a_100000765312_100011218657 [0,0,2,0,0,0|2,0,0]=4 2068 B14R1.520 COCC(C)SCCc1ccccc1 62a_100000765856_100000765312 [0,0,2,0,0,0|2,0,0]=4 2069 B14R1.520 COC[C@@H](C)NCCc1ccccc1 2230a_100000764878_100000765856 [0,0,2,0,0,0|1,0,0]=3 2070 B14R1.520 COC[C@@H](C)NCCc1ccccn1 2230a_100000764878_100015183660 [0,0,2,0,0,0|2,0,0]=4 2071 B14R1.520 COC[C@@H](C)NCCc1cccnc1 2230a_100000764878_200011713674 [0,0,2,0,0,0|2,0,0]=4 2072 B14R1.520 COC[C@@H](C)NCCc1ccncc1 2230a_100000764878_100000723409 [0,0,2,0,0,0|2,0,0]=4 2073 B14R1.520 COC[C@@H](C)NCSc1ccccc1 2230a_100000764878_100011218342 [0,0,2,0,0,0|2,0,0]=4 2074 B14R1.520 COC[C@@H](C)OCCc1ccccc1 34a_100011934205_100000765856 [0,0,2,0,0,0|2,0,0]=4 2075 B14R1.520 CSCC(C)NCCc1ccccc1 270004a_100000106460_100011216314 [0,0,2,0,0,0|1,0,0]=3 2076 B14R1.520 CSCC(C)NCCc1ccccn1 270004a_100000211156_100011216314 [0,0,2,0,0,0|2,0,0]=4 2077 B14R1.520 CSCC(C)NCCc1cccnc1 270004a_100000736294_100011216314 [0,0,2,0,0,0|2,0,0]=4 2078 B14R1.520 CSCC(C)NCCc1ccncc1 270004a_100000742849_100011216314 [0,0,2,0,0,0|2,0,0]=4 2079 B14R1.520 C[C@@H](CC#N)NCCc1ccccc1 2230a_100016994482_100000765856 [0,0,2,0,0,0|1,0,1]=4 2080 B14R1.520 C[C@H](CCO)NCCc1ccccc1 2230a_100000706166_100000765856 [0,0,2,0,0,0|1,0,0]=3 2081 B14R1.520 C[C@H](CCO)NCCc1ccccc1 34a_100000706166_100000765856 [0,0,2,0,0,0|1,0,0]=3 2082 B14R1.520 C[C@H](CCO)NCCc1ccccn1 2230a_100000706166_100015183660 [0,0,2,0,0,0|2,0,0]=4 2083 B14R1.520 C[C@H](CCO)NCCc1cccnc1 2230a_100000706166_200011713674 [0,0,2,0,0,0|2,0,0]=4 2084 B14R1.520 C[C@H](CCO)NCCc1ccncc1 2230a_100000706166_100000723409 [0,0,2,0,0,0|2,0,0]=4 2085 B14R1.520 C[C@H](CCO)NCSc1ccccc1 2230a_100000706166_100011218342 [0,0,2,0,0,0|2,0,0]=4 2086 B14R1.979 CCCC(CC)NCc1ccccc1 207a_100000747048_100015611070 [0,0,2,0,0,0|2,0,0]=4 2087 B14R1.979 CCCC(CC)NCc1ccccc1 2230a_100000747048_100015291786 [0,0,2,0,0,0|2,0,0]=4 2088 B14R1.979 CCCC(CC)NCc1ccccc1 270004a_100000747048_100015611070 [0,0,2,0,0,0|2,0,0]=4 2089 B14R1.979 CCCC(CC)NCc1ccccc1 270004a_100015324214_100000687865 [0,0,2,0,0,0|2,0,0]=4 2090 B14R1.979 CCCC(CC)OCc1ccccc1 34a_100000687864_100015291786 [0,0,2,0,0,0|2,0,0]=4 2091 B14R1.979 CCCC(CC)OCc1ccccc1 7a_100000210790_100011219200 [0,0,2,0,0,0|2,0,0]=4 2092 B14R1.979 CCCC(CC)OCc1ccccc1 7a_100000687864_100000211182 [0,0,2,0,0,0|2,0,0]=4 2093 B14R1.979 CCCC(CC)SCc1ccccc1 62a_100000211182_100011219200 [0,0,2,0,0,0|2,0,0]=4 2094 B14R1.979 CCCC(CC)SCc1ccccc1 62a_100011219200_100015291786 [0,0,2,0,0,0|2,0,0]=4 2095 B14R1.979 CCCC(CCc1ccccc1)NC 270004a_106832991635_100000759375 [0,0,2,0,0,0|0,0,0]=2 2096 B14R1.979 CCCN(CC)CCc1ccccc1 2230a_100000226822_100000765856 [0,0,2,0,0,0|2,0,0]=4 2097 B14R1.979 CCCN(CC)CCc1ccccc1 2230a_100000741020_100000210303 [0,0,2,0,0,0|2,0,0]=4 2098 B14R1.979 CCCN(CC)CCc1ccccc1 269982a_100000226822_100000765856 [0,0,2,0,0,0|2,0,0]=4 2099 B14R1.979 CCCN(CC)CCc1ccccc1 269982a_100000741020_100000210303 [0,0,2,0,0,0|2,0,0]=4 2100 B14R1.979 CCNC(CC)CCc1ccccc1 270004a_100015525214_100011279265 [0,0,2,0,0,0|2,0,0]=4 2101 B14R1.123 BrCCCCOCCc1ccccc1 34a_100011216708_100000765856 [0,0,2,0,0,0|2,0,0]=4 2102 B14R1.123 C#CCCCNCCc1ccccc1 2230a_100000106460_100000731252 [0,0,2,0,0,0|0,0,2]=4 2103 B14R1.123 C#CCCCNCCc1ccccc1 34a_100000106460_100000695029 [0,0,2,0,0,0|0,0,2]=4 2104 B14R1.123 C#CCCCNCCc1ccccc1 34a_100000718082_100000765856 [0,0,2,0,0,0|0,0,2]=4 2105 B14R1.123 C=CCCCNCCc1ccccc1 2230a_100000106460_100011713584 [0,0,2,0,0,0|0,0,2]=4 2106 B14R1.123 C=CCCCNCCc1ccccc1 2230a_100000700776_100000765856 [0,0,2,0,0,0|0,0,2]=4 2107 B14R1.123 C=CCCCNCCc1ccccc1 34a_100000106460_100000757094 [0,0,2,0,0,0|0,0,2]=4 2108 B14R1.123 C=CCCCNCCc1ccccc1 34a_100000700776_100000765856 [0,0,2,0,0,0|0,0,2]=4 2109 B14R1.123 CC/C=C\CNCCc1ccccc1 2230a_100000106460_100103147603 [0,0,2,0,0,0|0,0,2]=4 2110 B14R1.123 CC/C=C\CNCCc1ccccc1 34a_100000106460_100103147603 [0,0,2,0,0,0|0,0,2]=4 2111 B14R1.123 CCC#CCNCCc1ccccc1 2230a_100000106460_100009813939 [0,0,2,0,0,0|0,0,2]=4 2112 B14R1.123 CCC#CCNCCc1ccccc1 34a_100000106460_100009813939 [0,0,2,0,0,0|0,0,2]=4 2113 B14R1.123 CCCC=NNCCc1ccccc1 4a_100000740470_100000185831 [0,0,2,0,0,0|1,0,1]=4 2114 B14R1.123 CCCCCCCNc1ccccc1 34a_100000106764_100000210614 [0,0,2,0,0,0|2,0,0]=4 2115 B14R1.123 CCCCCCCOc1ccccc1 34a_100000210340_100000210614 [0,0,2,0,0,0|2,0,0]=4 2116 B14R1.123 CCCCCCCOc1ccccc1 7a_100000210340_100000210614 [0,0,2,0,0,0|2,0,0]=4 2117 B14R1.123 CCCCCCCSc1ccccc1 62a_100000210614_100000041952 [0,0,2,0,0,0|2,0,0]=4 2118 B14R1.123 CCCCCCCSc1ccccc1 62a_100000719477_100000210316 [0,0,2,0,0,0|2,0,0]=4 2119 B14R1.123 CCCCCCNCc1ccccc1 207a_100000210581_100015611070 [0,0,2,0,0,0|2,0,0]=4 2120 B14R1.123 CCCCCCNCc1ccccc1 2230a_100000210581_100015291786 [0,0,2,0,0,0|2,0,0]=4 2121 B14R1.123 CCCCCCNCc1ccccc1 2230a_100015324214_100000210314 [0,0,2,0,0,0|2,0,0]=4 2122 B14R1.123 CCCCCCNCc1ccccc1 270004a_100000210581_100015611070 [0,0,2,0,0,0|2,0,0]=4 2123 B14R1.123 CCCCCCNCc1ccccc1 34a_100015324214_100000210314 [0,0,2,0,0,0|2,0,0]=4 2124 B14R1.123 CCCCCCOCc1ccccc1 34a_100000210259_100015291786 [0,0,2,0,0,0|2,0,0]=4 2125 B14R1.123 CCCCCCOCc1ccccc1 34a_100000210790_100000210314 [0,0,2,0,0,0|2,0,0]=4 2126 B14R1.123 CCCCCCOCc1ccccc1 7a_100000210259_100000211182 [0,0,2,0,0,0|2,0,0]=4 2127 B14R1.123 CCCCCCOCc1ccccc1 7a_100000210790_100000210314 [0,0,2,0,0,0|2,0,0]=4 2128 B14R1.123 CCCCCCSCc1ccccc1 62a_100000210314_100015291786 [0,0,2,0,0,0|2,0,0]=4 2129 B14R1.123 CCCCCCSCc1ccccc1 62a_100000211182_100000210757 [0,0,2,0,0,0|2,0,0]=4 2130 B14R1.123 CCCCCNCCc1ccccc1 2230a_100000106460_100000210326 [0,0,2,0,0,0|0,0,0]=2 2131 B14R1.123 CCCCCNCCc1ccccc1 2230a_100000209983_100000765856 [0,0,2,0,0,0|0,0,0]=2 2132 B14R1.123 CCCCCNCCc1ccccc1 34a_100000106460_100000718602 [0,0,2,0,0,0|0,0,0]=2 2133 B14R1.123 CCCCCNCCc1ccccn1 2230a_100000209983_100015183660 [0,0,2,0,0,0|1,0,0]=3 2134 B14R1.123 CCCCCNCCc1cccnc1 2230a_100000209983_200011713674 [0,0,2,0,0,0|1,0,0]=3 2135 B14R1.123 CCCCCNCCc1cccnc1 2230a_100000736294_100000210326 [0,0,2,0,0,0|1,0,0]=3 2136 B14R1.123 CCCCCNCCc1ccncc1 2230a_100000209983_100000723409 [0,0,2,0,0,0|1,0,0]=3 2137 B14R1.123 CCCCCNCSc1ccccc1 2230a_100000209983_100011218342 [0,0,2,0,0,0|1,0,0]=3 2138 B14R1.123 CCCCCNN=Cc1ccccc1 4a_100000694160_100015611070 [0,0,2,0,0,0|1,0,1]=4 2139 B14R1.123 CCCCCOCCc1ccccc1 34a_100000210253_100000765856 [0,0,2,0,0,0|1,0,0]=3 2140 B14R1.123 CCCCCOCCc1ccccc1 34a_100000210268_100000718602 [0,0,2,0,0,0|1,0,0]=3 2141 B14R1.123 CCCCCOCCc1ccccc1 7a_100000210253_100000765856 [0,0,2,0,0,0|1,0,0]=3 2142 B14R1.123 CCCCCOCCc1ccccc1 7a_100000210268_100000210326 [0,0,2,0,0,0|1,0,0]=3 2143 B14R1.123 CCCCCOCCc1ccccn1 34a_100000210271_100000718602 [0,0,2,0,0,0|2,0,0]=4 2144 B14R1.123 CCCCCOCCc1ccccn1 7a_100000210253_100015183660 [0,0,2,0,0,0|2,0,0]=4 2145 B14R1.123 CCCCCOCCc1cccnc1 34a_100011217484_100000718602 [0,0,2,0,0,0|2,0,0]=4 2146 B14R1.123 CCCCCOCCc1cccnc1 7a_100000210253_200011713674 [0,0,2,0,0,0|2,0,0]=4 2147 B14R1.123 CCCCCOCCc1ccncc1 34a_100011216225_100000718602 [0,0,2,0,0,0|2,0,0]=4 2148 B14R1.123 CCCCCOCCc1ccncc1 7a_100000210253_100000723409 [0,0,2,0,0,0|2,0,0]=4 2149 B14R1.123 CCCCCSCCc1ccccc1 62a_100000210326_100011218657 [0,0,2,0,0,0|1,0,0]=3 2150 B14R1.123 CCCCCSCCc1ccccc1 62a_100000765856_100000210326 [0,0,2,0,0,0|1,0,0]=3 2151 B14R1.123 CCCCCSCCc1ccccn1 62a_100000210326_100015183660 [0,0,2,0,0,0|2,0,0]=4 2152 B14R1.123 CCCCCSCCc1ccccn1 62a_100015183660_100000210326 [0,0,2,0,0,0|2,0,0]=4 2153 B14R1.123 CCCCCSCCc1cccnc1 62a_100000210326_200011713674 [0,0,2,0,0,0|2,0,0]=4 2154 B14R1.123 CCCCCSCCc1cccnc1 62a_200011713674_100000210326 [0,0,2,0,0,0|2,0,0]=4 2155 B14R1.123 CCCCCSCCc1ccncc1 62a_100000210326_100000723409 [0,0,2,0,0,0|2,0,0]=4 2156 B14R1.123 CCCCCSCCc1ccncc1 62a_100000723409_100000210326 [0,0,2,0,0,0|2,0,0]=4 2157 B14R1.123 CCCCCSCSc1ccccc1 62a_100000210326_100011218342 [0,0,2,0,0,0|2,0,0]=4 2158 B14R1.123 CCCCCSCSc1ccccc1 62a_100011218342_100000210326 [0,0,2,0,0,0|2,0,0]=4 2159 B14R1.123 CCCCNCCCc1ccccc1 2230a_100000102301_100000211621 [0,0,2,0,0,0|2,0,0]=4 2160 B14R1.123 CCCCNCCCc1ccccc1 2230a_100000211184_100000210211 [0,0,2,0,0,0|2,0,0]=4 2161 B14R1.123 CCCCNCCCc1ccccc1 34a_100000211184_100000210210 [0,0,2,0,0,0|2,0,0]=4 2162 B14R1.123 CCCCNCCCc1ccccc1 7a_106832991798_100000211621 [0,0,2,0,0,0|2,0,0]=4 2163 B14R1.123 CCCCOCCCc1ccccc1 34a_100000210227_100000211621 [0,0,2,0,0,0|2,0,0]=4 2164 B14R1.123 CCCCOCCCc1ccccc1 34a_100000210828_100000210210 [0,0,2,0,0,0|2,0,0]=4 2165 B14R1.123 CCCCOCCCc1ccccc1 7a_100000210227_100000211621 [0,0,2,0,0,0|2,0,0]=4 2166 B14R1.123 CCCCOCCCc1ccccc1 7a_100000210828_100000210211 [0,0,2,0,0,0|2,0,0]=4 2167 B14R1.123 CCCCSCCCc1ccccc1 62a_100000210211_100000211621 [0,0,2,0,0,0|2,0,0]=4 2168 B14R1.123 CCCCSCCCc1ccccc1 62a_100000211621_100000210210 [0,0,2,0,0,0|2,0,0]=4 2169 B14R1.123 CCCNCCCCc1ccccc1 2230a_100015280158_100000210303 [0,0,2,0,0,0|2,0,0]=4 2170 B14R1.123 CCCNCCCCc1ccccc1 34a_100015280158_100000210303 [0,0,2,0,0,0|2,0,0]=4 2171 B14R1.123 CCCOCCCCc1ccccc1 34a_100000210258_100000701786 [0,0,2,0,0,0|2,0,0]=4 2172 B14R1.123 CCCOCCCCc1ccccc1 34a_100000703073_100000210303 [0,0,2,0,0,0|2,0,0]=4 2173 B14R1.123 CCCOCCCCc1ccccc1 7a_100000703073_100000210303 [0,0,2,0,0,0|2,0,0]=4 2174 B14R1.123 CCCSCCCCc1ccccc1 62a_100000210303_100000701786 [0,0,2,0,0,0|2,0,0]=4 2175 B14R1.123 CCCSCCCCc1ccccc1 62a_100000701786_100000210303 [0,0,2,0,0,0|2,0,0]=4 2176 B14R1.123 CCNCCCCCc1ccccc1 2230a_100000750932_100000210202 [0,0,2,0,0,0|2,0,0]=4 2177 B14R1.123 CCNCCCCCc1ccccc1 2230a_100015525214_200011217138 [0,0,2,0,0,0|2,0,0]=4 2178 B14R1.123 CCNCCCCCc1ccccc1 34a_100000750932_100000210202 [0,0,2,0,0,0|2,0,0]=4 2179 B14R1.123 CCOCCCCCc1ccccc1 34a_100121572206_200011217138 [0,0,2,0,0,0|2,0,0]=4 2180 B14R1.123 CCOCCCCCc1ccccc1 34a_200011219639_100000210202 [0,0,2,0,0,0|2,0,0]=4 2181 B14R1.123 CCOCCCCCc1ccccc1 7a_200011219639_100000210202 [0,0,2,0,0,0|2,0,0]=4 2182 B14R1.123 CCOCCNCCc1ccccc1 2230a_100000106460_100011215890 [0,0,2,0,0,0|1,0,0]=3 2183 B14R1.123 CCOCCNCCc1ccccc1 2230a_102516460346_100000765856 [0,0,2,0,0,0|1,0,0]=3 2184 B14R1.123 CCOCCNCCc1ccccc1 34a_100000106460_100000210147 [0,0,2,0,0,0|1,0,0]=3 2185 B14R1.123 CCOCCNCCc1ccccc1 34a_102516460346_100000765856 [0,0,2,0,0,0|1,0,0]=3 2186 B14R1.123 CCOCCNCCc1ccccn1 2230a_102516460346_100015183660 [0,0,2,0,0,0|2,0,0]=4 2187 B14R1.123 CCOCCNCCc1cccnc1 2230a_100000736294_100011215890 [0,0,2,0,0,0|2,0,0]=4 2188 B14R1.123 CCOCCNCCc1cccnc1 2230a_102516460346_200011713674 [0,0,2,0,0,0|2,0,0]=4 2189 B14R1.123 CCOCCNCCc1ccncc1 2230a_102516460346_100000723409 [0,0,2,0,0,0|2,0,0]=4 2190 B14R1.123 CCOCCNCSc1ccccc1 2230a_102516460346_100011218342 [0,0,2,0,0,0|2,0,0]=4 2191 B14R1.123 CCOCCOCCc1ccccc1 34a_100000210136_100000765856 [0,0,2,0,0,0|2,0,0]=4 2192 B14R1.123 CCOCCOCCc1ccccc1 34a_100000210268_100000210147 [0,0,2,0,0,0|2,0,0]=4 2193 B14R1.123 CCOCCOCCc1ccccc1 7a_100000210136_100000765856 [0,0,2,0,0,0|2,0,0]=4 2194 B14R1.123 CCOCCOCCc1ccccc1 7a_100000210268_100011215890 [0,0,2,0,0,0|2,0,0]=4 2195 B14R1.123 CCOCCSCCc1ccccc1 62a_100000210147_100011218657 [0,0,2,0,0,0|2,0,0]=4 2196 B14R1.123 CCOCCSCCc1ccccc1 62a_100000765856_100011215890 [0,0,2,0,0,0|2,0,0]=4 2197 B14R1.123 CCSCCCCCc1ccccc1 62a_100000210202_200011217138 [0,0,2,0,0,0|2,0,0]=4 2198 B14R1.123 CCSCCCCCc1ccccc1 62a_200011217138_100000210202 [0,0,2,0,0,0|2,0,0]=4 2199 B14R1.123 CCSCCNCCc1ccccc1 2230a_100000106460_100000757381 [0,0,2,0,0,0|1,0,0]=3 2200 B14R1.123 CCSCCNCCc1ccccc1 2230a_100000106463_100000765856 [0,0,2,0,0,0|1,0,0]=3 2201 B14R1.123 CCSCCNCCc1ccccc1 34a_100000106460_100000757381 [0,0,2,0,0,0|1,0,0]=3 2202 B14R1.123 CCSCCNCCc1ccccn1 2230a_100000106463_100015183660 [0,0,2,0,0,0|2,0,0]=4 2203 B14R1.123 CCSCCNCCc1cccnc1 2230a_100000106463_200011713674 [0,0,2,0,0,0|2,0,0]=4 2204 B14R1.123 CCSCCNCCc1cccnc1 2230a_100000736294_100000757381 [0,0,2,0,0,0|2,0,0]=4 2205 B14R1.123 CCSCCNCCc1ccncc1 2230a_100000106463_100000723409 [0,0,2,0,0,0|2,0,0]=4 2206 B14R1.123 CCSCCNCSc1ccccc1 2230a_100000106463_100011218342 [0,0,2,0,0,0|2,0,0]=4 2207 B14R1.123 CCSCCOCCc1ccccc1 34a_100000210268_100000757381 [0,0,2,0,0,0|2,0,0]=4 2208 B14R1.123 CCSCCOCCc1ccccc1 34a_100000212035_100000765856 [0,0,2,0,0,0|2,0,0]=4 2209 B14R1.123 CCSCCOCCc1ccccc1 7a_100000210268_100000757381 [0,0,2,0,0,0|2,0,0]=4 2210 B14R1.123 CCSCCOCCc1ccccc1 7a_100000212035_100000765856 [0,0,2,0,0,0|2,0,0]=4 2211 B14R1.123 CCSCCSCCc1ccccc1 62a_100000757381_100011218657 [0,0,2,0,0,0|2,0,0]=4 2212 B14R1.123 CCSCCSCCc1ccccc1 62a_100000765856_100000757381 [0,0,2,0,0,0|2,0,0]=4 2213 B14R1.123 CNCCCCCCc1ccccc1 2230a_106832991635_100011218729 [0,0,2,0,0,0|0,0,0]=2 2214 B14R1.123 CNCCCCCCc1ccccc1 34a_100102657272_100011218729 [0,0,2,0,0,0|0,0,0]=2 2215 B14R1.123 CNCCCCCCc1ccccc1 7a_106832991635_100011218729 [0,0,2,0,0,0|0,0,0]=2 2216 B14R1.123 CNCCCCCOc1ccccc1 2230a_106832991635_200011777167 [0,0,2,0,0,0|1,0,0]=3 2217 B14R1.123 CNCCCCCOc1ccccc1 34a_100102657272_200011777167 [0,0,2,0,0,0|1,0,0]=3 2218 B14R1.123 CNCCCCCOc1ccccc1 7a_106832991635_200011777167 [0,0,2,0,0,0|1,0,0]=3 2219 B14R1.123 CNCCCCOCc1ccccc1 2230a_100000748060_200000210301 [0,0,2,0,0,0|1,0,0]=3 2220 B14R1.123 CNCCCCOCc1ccccc1 2230a_106832991635_100011219843 [0,0,2,0,0,0|1,0,0]=3 2221 B14R1.123 CNCCCCOCc1ccccc1 34a_100000748060_200000210301 [0,0,2,0,0,0|1,0,0]=3 2222 B14R1.123 CNCCCCOCc1ccccc1 34a_100102657272_100011219843 [0,0,2,0,0,0|1,0,0]=3 2223 B14R1.123 CNCCCCOCc1ccccc1 7a_106832991635_100011219843 [0,0,2,0,0,0|1,0,0]=3 2224 B14R1.123 CNCCCOCCc1ccccc1 34a_100000213112_100000765856 [0,0,2,0,0,0|1,0,0]=3 2225 B14R1.123 COCCCCCCc1ccccc1 34a_100011215581_200000210301 [0,0,2,0,0,0|1,0,0]=3 2226 B14R1.123 COCCCCCCc1ccccc1 34a_100138415774_100011218729 [0,0,2,0,0,0|1,0,0]=3 2227 B14R1.123 COCCCCCCc1ccccc1 7a_100011215581_200000210301 [0,0,2,0,0,0|1,0,0]=3 2228 B14R1.123 COCCCCCOc1ccccc1 34a_100138415774_200011777167 [0,0,2,0,0,0|2,0,0]=4 2229 B14R1.123 COCCCCNCc1ccccc1 2230a_100015324214_100000730899 [0,0,2,0,0,0|2,0,0]=4 2230 B14R1.123 COCCCCNCc1ccccc1 34a_100000186360_200000210301 [0,0,2,0,0,0|2,0,0]=4 2231 B14R1.123 COCCCCNCc1ccccc1 34a_100015324214_100000755781 [0,0,2,0,0,0|2,0,0]=4 2232 B14R1.123 COCCCCOCc1ccccc1 34a_100000210790_100000755781 [0,0,2,0,0,0|2,0,0]=4 2233 B14R1.123 COCCCCOCc1ccccc1 34a_100000740925_100015291786 [0,0,2,0,0,0|2,0,0]=4 2234 B14R1.123 COCCCCOCc1ccccc1 34a_100011215074_200000210301 [0,0,2,0,0,0|2,0,0]=4 2235 B14R1.123 COCCCCOCc1ccccc1 34a_100138415774_100011219843 [0,0,2,0,0,0|2,0,0]=4 2236 B14R1.123 COCCCCOCc1ccccc1 7a_100000210790_100000730899 [0,0,2,0,0,0|2,0,0]=4 2237 B14R1.123 COCCCCOCc1ccccc1 7a_100011215074_200000210301 [0,0,2,0,0,0|2,0,0]=4 2238 B14R1.123 COCCCCSCc1ccccc1 62a_100000211182_100000730899 [0,0,2,0,0,0|2,0,0]=4 2239 B14R1.123 COCCCCSCc1ccccc1 62a_100000730899_100015291786 [0,0,2,0,0,0|2,0,0]=4 2240 B14R1.123 COCCCNCCc1ccccc1 2230a_100000106460_100000740836 [0,0,2,0,0,0|1,0,0]=3 2241 B14R1.123 COCCCNCCc1ccccc1 34a_100000106460_100000740836 [0,0,2,0,0,0|1,0,0]=3 2242 B14R1.123 COCCCNCCc1ccccc1 34a_100150723488_100000765856 [0,0,2,0,0,0|1,0,0]=3 2243 B14R1.123 COCCCNCCc1cccnc1 2230a_100000736294_100000740836 [0,0,2,0,0,0|2,0,0]=4 2244 B14R1.123 COCCCOCCc1ccccc1 34a_100000210268_100000740836 [0,0,2,0,0,0|2,0,0]=4 2245 B14R1.123 COCCCOCCc1ccccc1 34a_100000740835_100000765856 [0,0,2,0,0,0|2,0,0]=4 2246 B14R1.123 COCCCOCCc1ccccc1 7a_100000210268_100000740836 [0,0,2,0,0,0|2,0,0]=4 2247 B14R1.123 COCCCSCCc1ccccc1 62a_100000709357_100011218657 [0,0,2,0,0,0|2,0,0]=4 2248 B14R1.123 COCCCSCCc1ccccc1 62a_100000765856_100000709357 [0,0,2,0,0,0|2,0,0]=4 2249 B14R1.123 COCCNCCCc1ccccc1 2230a_100000209980_100000211621 [0,0,2,0,0,0|2,0,0]=4 2250 B14R1.123 COCCNCCCc1ccccc1 2230a_100000211184_100011201679 [0,0,2,0,0,0|2,0,0]=4 2251 B14R1.123 COCCNCCCc1ccccc1 34a_100000211184_100011201679 [0,0,2,0,0,0|2,0,0]=4 2252 B14R1.123 COCCOCCCc1ccccc1 34a_100000210237_100000211621 [0,0,2,0,0,0|2,0,0]=4 2253 B14R1.123 COCCOCCCc1ccccc1 34a_100000210828_100011201679 [0,0,2,0,0,0|2,0,0]=4 2254 B14R1.123 COCCOCCCc1ccccc1 7a_100000210828_100000233755 [0,0,2,0,0,0|2,0,0]=4 2255 B14R1.123 COCCSCCCc1ccccc1 62a_100000211621_100000233755 [0,0,2,0,0,0|2,0,0]=4 2256 B14R1.123 COCCSCCCc1ccccc1 62a_100000233755_100000211621 [0,0,2,0,0,0|2,0,0]=4 2257 B14R1.123 COCNCCCCc1ccccc1 2230a_100015280158_100000766300 [0,0,2,0,0,0|2,0,0]=4 2258 B14R1.123 COCSCCCCc1ccccc1 62a_100000701786_100000766300 [0,0,2,0,0,0|2,0,0]=4 2259 B14R1.123 COCSCCCCc1ccccc1 62a_100000766300_100000701786 [0,0,2,0,0,0|2,0,0]=4 2260 B14R1.123 CSCCCCCCc1ccccc1 62a_100011218729_200000210301 [0,0,2,0,0,0|1,0,0]=3 2261 B14R1.123 CSCCCCCCc1ccccc1 62a_200000210301_100011218729 [0,0,2,0,0,0|1,0,0]=3 2262 B14R1.123 CSCCCCCOc1ccccc1 62a_200000210301_200011777167 [0,0,2,0,0,0|2,0,0]=4 2263 B14R1.123 CSCCCCCOc1ccccc1 62a_200011777167_200000210301 [0,0,2,0,0,0|2,0,0]=4 2264 B14R1.123 CSCCCCOCc1ccccc1 34a_100011217163_100015291786 [0,0,2,0,0,0|2,0,0]=4 2265 B14R1.123 CSCCCCOCc1ccccc1 62a_100011219843_200000210301 [0,0,2,0,0,0|2,0,0]=4 2266 B14R1.123 CSCCCCOCc1ccccc1 62a_200000210301_100011219843 [0,0,2,0,0,0|2,0,0]=4 2267 B14R1.123 CSCCCCOCc1ccccc1 7a_100011217163_100000211182 [0,0,2,0,0,0|2,0,0]=4 2268 B14R1.123 CSCCCNCCc1ccccc1 2230a_100000749238_100000765856 [0,0,2,0,0,0|1,0,0]=3 2269 B14R1.123 CSCCCNCCc1ccccn1 2230a_100000749238_100015183660 [0,0,2,0,0,0|2,0,0]=4 2270 B14R1.123 CSCCCNCCc1cccnc1 2230a_100000749238_200011713674 [0,0,2,0,0,0|2,0,0]=4 2271 B14R1.123 CSCCCNCCc1ccncc1 2230a_100000749238_100000723409 [0,0,2,0,0,0|2,0,0]=4 2272 B14R1.123 CSCCCNCSc1ccccc1 2230a_100000749238_100011218342 [0,0,2,0,0,0|2,0,0]=4 2273 B14R1.123 CSCCCOCCc1ccccc1 34a_100000690336_100000765856 [0,0,2,0,0,0|2,0,0]=4 2274 B14R1.123 CSCCCOCCc1ccccc1 7a_100000690336_100000765856 [0,0,2,0,0,0|2,0,0]=4 2275 B14R1.123 CSCCNCCCc1ccccc1 2230a_100000211184_100000751147 [0,0,2,0,0,0|2,0,0]=4 2276 B14R1.123 CSCCNCCCc1ccccc1 2230a_100020590264_100000211621 [0,0,2,0,0,0|2,0,0]=4 2277 B14R1.123 CSCCNCCCc1ccccc1 34a_100000211184_100000212216 [0,0,2,0,0,0|2,0,0]=4 2278 B14R1.123 CSCCOCCCc1ccccc1 34a_100000210828_100000212216 [0,0,2,0,0,0|2,0,0]=4 2279 B14R1.123 CSCCOCCCc1ccccc1 34a_100000230434_100000211621 [0,0,2,0,0,0|2,0,0]=4 2280 B14R1.123 CSCCOCCCc1ccccc1 7a_100000210828_100000212216 [0,0,2,0,0,0|2,0,0]=4 2281 B14R1.123 CSCCOCCCc1ccccc1 7a_100000230434_100000211621 [0,0,2,0,0,0|2,0,0]=4 2282 B14R1.123 CSCCSCCCc1ccccc1 62a_100000211621_100000751147 [0,0,2,0,0,0|2,0,0]=4 2283 B14R1.123 CSCCSCCCc1ccccc1 62a_100000212216_100000211621 [0,0,2,0,0,0|2,0,0]=4 2284 B14R1.123 CSCNCCCCc1ccccc1 2230a_100015280158_100011218213 [0,0,2,0,0,0|2,0,0]=4 2285 B14R1.123 CSCNCCCCc1ccccc1 34a_100015280158_100011218213 [0,0,2,0,0,0|2,0,0]=4 2286 B14R1.123 CSCOCCCCc1ccccc1 34a_100000703073_100011218213 [0,0,2,0,0,0|2,0,0]=4 2287 B14R1.123 CSCSCCCCc1ccccc1 62a_100000701786_100011218213 [0,0,2,0,0,0|2,0,0]=4 2288 B14R1.123 CSCSCCCCc1ccccc1 62a_100011218213_100000701786 [0,0,2,0,0,0|2,0,0]=4 2289 B14R1.123 ClCCCCOCCc1ccccc1 34a_100000210776_100000765856 [0,0,2,0,0,0|2,0,0]=4 2290 B14R1.123 ClCCCCOCCc1ccccc1 7a_100000210776_100000765856 [0,0,2,0,0,0|2,0,0]=4 2291 B14R1.123 FCCCCNCCc1ccccc1 2230a_100000106460_100000729493 [0,0,2,0,0,0|1,0,0]=3 2292 B14R1.123 FCCCCNCCc1ccccc1 34a_100000106460_100000729493 [0,0,2,0,0,0|1,0,0]=3 2293 B14R1.123 FCCCCNCCc1cccnc1 2230a_100000736294_100000729493 [0,0,2,0,0,0|2,0,0]=4 2294 B14R1.123 FCCCCOCCc1ccccc1 34a_100000210268_100000729493 [0,0,2,0,0,0|2,0,0]=4 2295 B14R1.123 FCCCCOCCc1ccccc1 34a_100011995726_100000765856 [0,0,2,0,0,0|2,0,0]=4 2296 B14R1.123 FCCCCOCCc1ccccc1 7a_100000210268_100000729493 [0,0,2,0,0,0|2,0,0]=4 2297 B14R1.123 FCCCCOCCc1ccccc1 7a_100011995726_100000765856 [0,0,2,0,0,0|2,0,0]=4 2298 B14R1.123 FCCCCSCCc1ccccc1 62a_100000729493_100011218657 [0,0,2,0,0,0|2,0,0]=4 2299 B14R1.123 FCCCCSCCc1ccccc1 62a_100000765856_100000729493 [0,0,2,0,0,0|2,0,0]=4 2300 B14R1.123 ICCCCOCCc1ccccc1 34a_200012148704_100000765856 [0,0,2,0,0,0|2,0,0]=4 2301 B14R1.123 N#CCCCNCCc1ccccc1 2230a_100000106460_100000687738 [0,0,2,0,0,0|1,0,1]=4 2302 B14R1.123 NCCCCOCCc1ccccc1 34a_100000750430_100000765856 [0,0,2,0,0,0|2,0,0]=4 2303 B14R1.123 O=CCCCNCCc1ccccc1 2230a_100000106460_200011292268 [0,0,2,0,0,0|1,0,1]=4 2304 B14R1.123 OCCCCNCCc1ccccc1 2230a_100000106460_100000210776 [0,0,2,0,0,0|1,0,0]=3 2305 B14R1.123 OCCCCNCCc1ccccc1 2230a_100000750430_100000765856 [0,0,2,0,0,0|1,0,0]=3 2306 B14R1.123 OCCCCNCCc1ccccc1 34a_100000106460_100011216708 [0,0,2,0,0,0|1,0,0]=3 2307 B14R1.123 OCCCCNCCc1ccccc1 34a_100000750430_100000765856 [0,0,2,0,0,0|1,0,0]=3 2308 B14R1.123 OCCCCNCCc1ccccn1 2230a_100000750430_100015183660 [0,0,2,0,0,0|2,0,0]=4 2309 B14R1.123 OCCCCNCCc1cccnc1 2230a_100000736294_100000210776 [0,0,2,0,0,0|2,0,0]=4 2310 B14R1.123 OCCCCNCCc1cccnc1 2230a_100000750430_200011713674 [0,0,2,0,0,0|2,0,0]=4 2311 B14R1.123 OCCCCNCCc1ccncc1 2230a_100000750430_100000723409 [0,0,2,0,0,0|2,0,0]=4 2312 B14R1.123 OCCCCNCSc1ccccc1 2230a_100000750430_100011218342 [0,0,2,0,0,0|2,0,0]=4 2313 B14R1.123 OCCCCOCCc1ccccc1 34a_100000210268_100011216708 [0,0,2,0,0,0|2,0,0]=4 2314 B14R1.123 OCCCCOCCc1ccccc1 7a_100000210268_100000210776 [0,0,2,0,0,0|2,0,0]=4 2315 B14R1.123 OCCCCSCCc1ccccc1 62a_100000210776_100011218657 [0,0,2,0,0,0|2,0,0]=4 2316 B14R1.123 OCCCCSCCc1ccccc1 62a_100000765856_100000210776 [0,0,2,0,0,0|2,0,0]=4 2317 B14R1.123 [13CH3]NCCCCOCc1ccccc1 2230a_100000748060_200025704644 [0,0,2,0,0,0|1,0,0]=3 2318 B14R1.123 [13CH3]NCCCCOCc1ccccc1 34a_100000748060_200025704644 [0,0,2,0,0,0|1,0,0]=3 2319 B14R1.123 [13CH3]OCCCCCCc1ccccc1 34a_100011215581_200025704644 [0,0,2,0,0,0|1,0,0]=3 2320 B14R1.123 [13CH3]OCCCCCCc1ccccc1 7a_100011215581_200025704644 [0,0,2,0,0,0|1,0,0]=3 2321 B14R1.123 [13CH3]OCCCCNCc1ccccc1 34a_100000186360_200025704644 [0,0,2,0,0,0|2,0,0]=4 2322 B14R1.123 [13CH3]OCCCCOCc1ccccc1 34a_100011215074_200025704644 [0,0,2,0,0,0|2,0,0]=4 2323 B14R1.123 [13CH3]OCCCCOCc1ccccc1 7a_100011215074_200025704644 [0,0,2,0,0,0|2,0,0]=4 2324 B14R1.123 [13CH3]SCCCCCCc1ccccc1 62a_100011218729_200025704644 [0,0,2,0,0,0|1,0,0]=3 2325 B14R1.123 [13CH3]SCCCCCCc1ccccc1 62a_200025704644_100011218729 [0,0,2,0,0,0|1,0,0]=3 2326 B14R1.123 [13CH3]SCCCCCOc1ccccc1 62a_200011777167_200025704644 [0,0,2,0,0,0|2,0,0]=4 2327 B14R1.123 [13CH3]SCCCCCOc1ccccc1 62a_200025704644_200011777167 [0,0,2,0,0,0|2,0,0]=4 2328 B14R1.123 [13CH3]SCCCCOCc1ccccc1 62a_100011219843_200025704644 [0,0,2,0,0,0|2,0,0]=4 2329 B14R1.123 [13CH3]SCCCCOCc1ccccc1 62a_200025704644_100011219843 [0,0,2,0,0,0|2,0,0]=4 2330 B14R1.171 CCCC(=NNCC)c1ccccc1 4a_100000756455_100000211045 [0,0,2,0,0,0|1,0,1]=4 2331 B14R1.171 CCCCC(NCC)c1ccccc1 269862a_100015525214_100000211663 [0,0,2,0,0,0|2,0,0]=4 2332 B14R1.171 CCCCC(OCC)c1ccccc1 34a_100000698411_100000210202 [0,0,2,0,0,0|2,0,0]=4 2333 B14R1.171 CCCCC(OCC)c1ccccc1 7a_100000698411_100000210202 [0,0,2,0,0,0|2,0,0]=4 2334 B14R1.171 CCCCN(CCC)c1ccccc1 2230a_100000211623_100000210303 [0,0,2,0,0,0|2,0,0]=4 2335 B14R1.171 CCCCN(CCC)c1ccccc1 2230a_200011218496_100000210211 [0,0,2,0,0,0|2,0,0]=4 2336 B14R1.171 CCCCN(CCC)c1ccccc1 269982a_100000211623_100000210303 [0,0,2,0,0,0|2,0,0]=4 2337 B14R1.171 CCCCN(CCC)c1ccccc1 269982a_200011218496_100000210211 [0,0,2,0,0,0|2,0,0]=4 2338 B14R1.171 CCCCN(CCC)c1ccccc1 34a_100000211623_100000210303 [0,0,2,0,0,0|2,0,0]=4 2339 B14R1.171 CCCCN(CCC)c1ccccc1 34a_200011218496_100000210210 [0,0,2,0,0,0|2,0,0]=4 2340 B14R1.171 CCCCN(COC)c1ccccc1 2230a_100000211623_100000766300 [0,0,2,0,0,0|2,0,0]=4 2341 B14R1.171 CCCCN(COC)c1ccccc1 269982a_100000211623_100000766300 [0,0,2,0,0,0|2,0,0]=4 2342 B14R1.171 CCCCN(CSC)c1ccccc1 2230a_100000211623_100011218213 [0,0,2,0,0,0|2,0,0]=4 2343 B14R1.171 CCCCN(CSC)c1ccccc1 269982a_100000211623_100011218213 [0,0,2,0,0,0|2,0,0]=4 2344 B14R1.171 CCCCN(CSC)c1ccccc1 34a_100000211623_100011218213 [0,0,2,0,0,0|2,0,0]=4 2345 B14R1.171 CCCN(COCC)c1ccccc1 269982a_200011218496_100000739092 [0,0,2,0,0,0|2,0,0]=4 2346 B14R1.171 CCCNC(CCC)c1ccccc1 2230a_100000189686_100000210303 [0,0,2,0,0,0|2,0,0]=4 2347 B14R1.171 CCCNC(CCC)c1ccccc1 269862a_100020643023_100000211045 [0,0,2,0,0,0|2,0,0]=4 2348 B14R1.171 CCCNC(CCC)c1ccccc1 34a_100000189686_100000210303 [0,0,2,0,0,0|2,0,0]=4 2349 B14R1.171 CCCNC(COC)c1ccccc1 269862a_100020643023_100000765260 [0,0,2,0,0,0|2,0,0]=4 2350 B14R1.171 CCCN[C@H](COC)c1ccccc1 2230a_103619048568_100000210303 [0,0,2,0,0,0|2,0,0]=4 2351 B14R1.171 CCCN[C@H](COC)c1ccccc1 34a_103619048568_100000210303 [0,0,2,0,0,0|2,0,0]=4 2352 B14R1.171 CCCOC(CCC)c1ccccc1 34a_100000747916_100000210303 [0,0,2,0,0,0|2,0,0]=4 2353 B14R1.171 CCCOC(CCC)c1ccccc1 7a_100000747916_100000210303 [0,0,2,0,0,0|2,0,0]=4 2354 B14R1.478 CCCC(CC)N(C)c1ccccc1 269982a_100000210012_100011219200 [0,0,2,0,0,0|2,0,0]=4 2355 B14R1.478 CCCN(CC)C(C)c1ccccc1 2230a_100000226822_100000230085 [0,0,2,0,0,0|2,0,0]=4 2356 B14R1.478 CCCN(CC)C(C)c1ccccc1 2230a_100020603006_100000210202 [0,0,2,0,0,0|2,0,0]=4 2357 B14R1.478 CCCN(CC)C(C)c1ccccc1 269982a_100000226822_100000230085 [0,0,2,0,0,0|2,0,0]=4 2358 B14R1.478 CCCN(CC)C(C)c1ccccc1 269982a_100020603006_100000204670 [0,0,2,0,0,0|2,0,0]=4 2359 B14R1.478 CCCN(CF)C(C)c1ccccc1 269982a_100020603006_100015361967 [0,0,2,0,0,0|2,0,0]=4 2360 B14R1.494 CCCC(CCC)Nc1ccccc1 34a_100000106764_200011218217 [0,0,2,0,0,0|2,0,0]=4 2361 B14R1.494 CCCC(CCC)Oc1ccccc1 34a_100000210340_200011218217 [0,0,2,0,0,0|2,0,0]=4 2362 B14R1.494 CCCC(CCC)Oc1ccccc1 7a_100000210340_200011218217 [0,0,2,0,0,0|2,0,0]=4 2363 B14R1.494 CCCC(CCC)Sc1ccccc1 62a_100000719477_200011218217 [0,0,2,0,0,0|2,0,0]=4 2364 B14R1.494 CCCC(CCC)Sc1ccccc1 62a_200011218217_100000041952 [0,0,2,0,0,0|2,0,0]=4 2365 B14R1.494 CCCN(CCC)Cc1ccccc1 2230a_100000184400_100000210303 [0,0,2,0,0,0|2,0,0]=4 2366 B14R1.494 CCCN(CCC)Cc1ccccc1 2230a_100000210455_100015291786 [0,0,2,0,0,0|2,0,0]=4 2367 B14R1.494 CCCN(CCC)Cc1ccccc1 269982a_100000184400_100000210303 [0,0,2,0,0,0|2,0,0]=4 2368 B14R1.494 CCCN(CCC)Cc1ccccc1 269982a_100000210455_100000211182 [0,0,2,0,0,0|2,0,0]=4 2369 B14R1.494 CCCN(CCC)Cc1ccccc1 270004a_100000210455_100015611070 [0,0,2,0,0,0|2,0,0]=4 2370 B14R1.494 CCCN(COC)Cc1ccccc1 2230a_100000184400_100000766300 [0,0,2,0,0,0|2,0,0]=4 2371 B14R1.494 CCCN(COC)Cc1ccccc1 269982a_100000184400_100000766300 [0,0,2,0,0,0|2,0,0]=4 2372 B14R1.494 CCCN(CSC)Cc1ccccc1 2230a_100000184400_100011218213 [0,0,2,0,0,0|2,0,0]=4 2373 B14R1.494 CCCN(CSC)Cc1ccccc1 269982a_100000184400_100011218213 [0,0,2,0,0,0|2,0,0]=4 2374 B14R1.494 CCNC(COC)Cc1ccccc1 2230a_100000766165_100000210202 [0,0,2,0,0,0|2,0,0]=4 2375 B14R1.604 CCCC(C)N(CC)c1ccccc1 2230a_100000210013_100000766640 [0,0,2,0,0,0|2,0,0]=4 2376 B14R1.604 CCCC(C)N(CC)c1ccccc1 269982a_100000210013_100000766640 [0,0,2,0,0,0|2,0,0]=4 2377 B14R1.604 CCCC(C)N(CC)c1ccccc1 34a_100000210013_100000766640 [0,0,2,0,0,0|2,0,0]=4 2378 B14R1.604 CCCN(C)C(CC)c1ccccc1 2230a_100000737431_200000210301 [0,0,2,0,0,0|2,0,0]=4 2379 B14R1.604 CCCN(C)C(CC)c1ccccc1 2230a_100000737544_100000210303 [0,0,2,0,0,0|2,0,0]=4 2380 B14R1.604 CCCN(C)C(CC)c1ccccc1 269982a_100000737431_200000210301 [0,0,2,0,0,0|2,0,0]=4 2381 B14R1.604 CCCN(C)C(CC)c1ccccc1 269982a_100000737544_100000210303 [0,0,2,0,0,0|2,0,0]=4 2382 B14R1.604 CCCN([13CH3])C(CC)c1ccccc1 2230a_100000737431_200025704644 [0,0,2,0,0,0|2,0,0]=4 2383 B14R1.604 CCCN([13CH3])C(CC)c1ccccc1 269982a_100000737431_200025704644 [0,0,2,0,0,0|2,0,0]=4 2384 B14R1.532 CCC(CC)N(C)Cc1ccccc1 2230a_100000737045_100015291786 [0,0,2,0,0,0|2,0,0]=4 2385 B14R1.532 CCC(CC)N(C)Cc1ccccc1 2230a_100015183167_200000210301 [0,0,2,0,0,0|2,0,0]=4 2386 B14R1.532 CCC(CC)N(C)Cc1ccccc1 269982a_100000186898_100000210505 [0,0,2,0,0,0|2,0,0]=4 2387 B14R1.532 CCC(CC)N(C)Cc1ccccc1 269982a_100000737045_100000211182 [0,0,2,0,0,0|2,0,0]=4 2388 B14R1.532 CCC(CC)N(C)Cc1ccccc1 269982a_100015183167_200000210301 [0,0,2,0,0,0|2,0,0]=4 2389 B14R1.532 CCC(CC)N(C)Cc1ccccc1 270004a_100000186898_100000210860 [0,0,2,0,0,0|2,0,0]=4 2390 B14R1.532 CCC(CC)N(C)Cc1ccccc1 270004a_100000737045_100015611070 [0,0,2,0,0,0|2,0,0]=4 2391 B14R1.532 CCC(CC)N([13CH3])Cc1ccccc1 2230a_100015183167_200025704644 [0,0,2,0,0,0|2,0,0]=4 2392 B14R1.532 CCC(CC)N([13CH3])Cc1ccccc1 269982a_100015183167_200025704644 [0,0,2,0,0,0|2,0,0]=4 2393 B14R1.532 CCN(CC)C(C)Cc1ccccc1 269956a_100000042499_200011218536 [0,0,2,0,0,0|2,0,0]=4 2394 B14R1.532 CCN(CC)C(C)Cc1ccccc1 269982a_100000724800_200011218536 [0,0,2,0,0,0|2,0,0]=4 2395 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 2230a_100000186914_100000758301 [0,0,2,0,0,0|2,0,0]=4 2396 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 2230a_100000693180_100000210202 [0,0,2,0,0,0|2,0,0]=4 2397 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 2230a_100000732650_100015291786 [0,0,2,0,0,0|2,0,0]=4 2398 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 269982a_100000186914_100000758301 [0,0,2,0,0,0|2,0,0]=4 2399 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 269982a_100000693180_100000204670 [0,0,2,0,0,0|2,0,0]=4 2400 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 269982a_100000732650_100000211182 [0,0,2,0,0,0|2,0,0]=4 2401 B14R1.1031 CCC(C)N(CC)Cc1ccccc1 270004a_100000732650_100015611070 [0,0,2,0,0,0|2,0,0]=4 2402 B14R1.1031 CCN(Cc1ccccc1)C(C)OC 269982a_100000186914_100009879195 [0,0,2,0,0,0|2,0,0]=4 2403 B14R1.391 CCC(CC)N(CC)c1ccccc1 269982a_100000210013_100000210505 [0,0,2,0,0,0|2,0,0]=4 2404 B14R1.391 CCC(c1ccccc1)N(CC)CC 2230a_100000737450_100000210202 [0,0,2,0,0,0|2,0,0]=4 2405 B14R1.391 CCC(c1ccccc1)N(CC)CC 269982a_100000737450_100000204670 [0,0,2,0,0,0|2,0,0]=4 2406 B14R1.85 CCC(C)N(C)C(C)c1ccccc1 2230a_100000195388_100000758301 [0,0,2,0,0,0|2,0,0]=4 2407 B14R1.85 CCC(C)N(C)C(C)c1ccccc1 2230a_100000741768_100000230085 [0,0,2,0,0,0|2,0,0]=4 2408 B14R1.85 CCC(C)N(C)C(C)c1ccccc1 269982a_100000195388_100000758301 [0,0,2,0,0,0|2,0,0]=4 2409 B14R1.85 CCC(C)N(C)C(C)c1ccccc1 269982a_100000741768_100000230085 [0,0,2,0,0,0|2,0,0]=4 2410 B14R1.1017 CCN(C(C)C)C(C)c1ccccc1 2230a_100000223864_100000230085 [0,0,2,0,0,0|2,0,0]=4 2411 B14R1.1017 CCN(C(C)C)C(C)c1ccccc1 269982a_100000218734_100000204670 [0,0,2,0,0,0|2,0,0]=4 2412 B14R1.1017 CCN(C(C)C)C(C)c1ccccc1 269982a_100000223864_100000230085 [0,0,2,0,0,0|2,0,0]=4 2413 B14R1.177 C=CC=CC(=O)CCCC1CCCC1 1458a_100016291481_100011713738 [0,0,2,0,0,0|2,0,0]=4 2414 B14R1.546 CCC(CC)CNCc1ccccc1 207a_100102946423_100015611070 [0,0,2,0,0,0|2,0,0]=4 2415 B14R1.546 CCC(CC)CNCc1ccccc1 2230a_100015324214_100011215472 [0,0,2,0,0,0|2,0,0]=4 2416 B14R1.546 CCC(CC)CNCc1ccccc1 2230a_100102946423_100015291786 [0,0,2,0,0,0|2,0,0]=4 2417 B14R1.546 CCC(CC)CNCc1ccccc1 269862a_100015324214_100000211137 [0,0,2,0,0,0|2,0,0]=4 2418 B14R1.546 CCC(CC)CNCc1ccccc1 270004a_100015324214_100000211137 [0,0,2,0,0,0|2,0,0]=4 2419 B14R1.546 CCC(CC)CNCc1ccccc1 270004a_100102946423_100015611070 [0,0,2,0,0,0|2,0,0]=4 2420 B14R1.546 CCC(CC)CNCc1ccccc1 34a_100015324214_100011215472 [0,0,2,0,0,0|2,0,0]=4 2421 B14R1.546 CCC(CC)COCc1ccccc1 34a_100000210790_100011215472 [0,0,2,0,0,0|2,0,0]=4 2422 B14R1.546 CCC(CC)COCc1ccccc1 7a_100000210790_100011215472 [0,0,2,0,0,0|2,0,0]=4 2423 B14R1.546 CCC(CC)COCc1ccccc1 7a_100000703878_100000211182 [0,0,2,0,0,0|2,0,0]=4 2424 B14R1.546 CCC(CC)CSCc1ccccc1 62a_100000211182_100011215472 [0,0,2,0,0,0|2,0,0]=4 2425 B14R1.546 CCC(CC)CSCc1ccccc1 62a_100011215472_100015291786 [0,0,2,0,0,0|2,0,0]=4 2426 B14R1.546 CCC(CC)NCCc1ccccc1 2230a_100000199018_100000765856 [0,0,2,0,0,0|0,0,0]=2 2427 B14R1.546 CCC(CC)NCCc1ccccc1 270004a_100000106460_100000210860 [0,0,2,0,0,0|0,0,0]=2 2428 B14R1.546 CCC(CC)NCCc1ccccn1 2230a_100000199018_100015183660 [0,0,2,0,0,0|1,0,0]=3 2429 B14R1.546 CCC(CC)NCCc1ccccn1 270004a_100000211156_100000210860 [0,0,2,0,0,0|1,0,0]=3 2430 B14R1.546 CCC(CC)NCCc1cccnc1 2230a_100000199018_200011713674 [0,0,2,0,0,0|1,0,0]=3 2431 B14R1.546 CCC(CC)NCCc1cccnc1 270004a_100000736294_100000210860 [0,0,2,0,0,0|1,0,0]=3 2432 B14R1.546 CCC(CC)NCCc1ccncc1 2230a_100000199018_100000723409 [0,0,2,0,0,0|1,0,0]=3 2433 B14R1.546 CCC(CC)NCCc1ccncc1 270004a_100000742849_100000210860 [0,0,2,0,0,0|1,0,0]=3 2434 B14R1.546 CCC(CC)NCCc1cnccn1 270004a_100000723456_100000210860 [0,0,2,0,0,0|2,0,0]=4 2435 B14R1.546 CCC(CC)NCSc1ccccc1 2230a_100000199018_100011218342 [0,0,2,0,0,0|1,0,0]=3 2436 B14R1.546 CCC(CC)NN=Cc1ccccc1 4a_100000756293_100015611070 [0,0,2,0,0,0|1,0,1]=4 2437 B14R1.546 CCC(CC)OCCc1ccccc1 7a_100000210268_100000210505 [0,0,2,0,0,0|1,0,0]=3 2438 B14R1.546 CCC(CC)OCCc1ccccc1 7a_100000688536_100000765856 [0,0,2,0,0,0|1,0,0]=3 2439 B14R1.546 CCC(CC)OCCc1ccccn1 7a_100000688536_100015183660 [0,0,2,0,0,0|2,0,0]=4 2440 B14R1.546 CCC(CC)OCCc1cccnc1 7a_100000688536_200011713674 [0,0,2,0,0,0|2,0,0]=4 2441 B14R1.546 CCC(CC)OCCc1ccncc1 7a_100000688536_100000723409 [0,0,2,0,0,0|2,0,0]=4 2442 B14R1.546 CCC(CC)SCCc1ccccc1 62a_100000210505_100011218657 [0,0,2,0,0,0|1,0,0]=3 2443 B14R1.546 CCC(CC)SCCc1ccccc1 62a_100000765856_100000210505 [0,0,2,0,0,0|1,0,0]=3 2444 B14R1.546 CCC(CC)SCCc1ccccn1 62a_100000210505_100015183660 [0,0,2,0,0,0|2,0,0]=4 2445 B14R1.546 CCC(CC)SCCc1ccccn1 62a_100015183660_100000210505 [0,0,2,0,0,0|2,0,0]=4 2446 B14R1.546 CCC(CC)SCCc1cccnc1 62a_100000210505_200011713674 [0,0,2,0,0,0|2,0,0]=4 2447 B14R1.546 CCC(CC)SCCc1cccnc1 62a_200011713674_100000210505 [0,0,2,0,0,0|2,0,0]=4 2448 B14R1.546 CCC(CC)SCCc1ccncc1 62a_100000210505_100000723409 [0,0,2,0,0,0|2,0,0]=4 2449 B14R1.546 CCC(CC)SCCc1ccncc1 62a_100000723409_100000210505 [0,0,2,0,0,0|2,0,0]=4 2450 B14R1.546 CCC(CC)SCSc1ccccc1 62a_100000210505_100011218342 [0,0,2,0,0,0|2,0,0]=4 2451 B14R1.546 CCC(CC)SCSc1ccccc1 62a_100011218342_100000210505 [0,0,2,0,0,0|2,0,0]=4 2452 B14R1.546 CCN(CC)CCCc1ccccc1 2230a_100000724800_100000211621 [0,0,2,0,0,0|2,0,0]=4 2453 B14R1.546 CCN(CC)CCCc1ccccc1 269956a_100000042499_100000211621 [0,0,2,0,0,0|2,0,0]=4 2454 B14R1.546 CCN(CC)CCCc1ccccc1 269982a_100000724800_100000211621 [0,0,2,0,0,0|2,0,0]=4 2455 B14R1.546 CC[C@@H](CO)NCCc1ccccc1 2230a_100000709445_100000765856 [0,0,2,0,0,0|1,0,0]=3 2456 B14R1.546 CC[C@@H](CO)NCCc1ccccn1 2230a_100000709445_100015183660 [0,0,2,0,0,0|2,0,0]=4 2457 B14R1.546 CC[C@@H](CO)NCCc1cccnc1 2230a_100000709445_200011713674 [0,0,2,0,0,0|2,0,0]=4 2458 B14R1.546 CC[C@@H](CO)NCCc1ccncc1 2230a_100000709445_100000723409 [0,0,2,0,0,0|2,0,0]=4 2459 B14R1.546 CC[C@@H](CO)NCSc1ccccc1 2230a_100000709445_100011218342 [0,0,2,0,0,0|2,0,0]=4 2460 B14R1.546 OCC(CO)NCCc1ccccc1 2230a_100000759517_100000765856 [0,0,2,0,0,0|2,0,0]=4 2461 B16R3.1791 c1ccc(cc1)C2CCN(C2)C3CC3 269982a_100000747531_100000211595 [0,0,1,1,0,0|2,0,0]=4 2462 B16R3.1791 c1ccc(cc1)C2CCN(C2)C3CC3 34a_100000747531_100000211595 [0,0,1,1,0,0|2,0,0]=4 2463 B16R3.1787 c1ccc(cc1)C2CCCN2C3CC3 269982a_100000243309_100000211595 [0,0,1,1,0,0|2,0,0]=4 2464 B16R3.1787 c1ccc(cc1)C2CCCN2C3CC3 34a_100000243309_100000211595 [0,0,1,1,0,0|2,0,0]=4 2465 B16R3.5972 c1ccc(cc1)CN2CCCC23CC3 2230a_100020620911_100015291786 [0,0,1,1,0,0|2,0,0]=4 2466 B16R3.5972 c1ccc(cc1)CN2CCCC23CC3 269982a_100020620911_100000211182 [0,0,1,1,0,0|2,0,0]=4 2467 B16R3.5972 c1ccc(cc1)CN2CCCC23CC3 270004a_100020620911_100015611070 [0,0,1,1,0,0|2,0,0]=4 2468 B16R3.5972 c1ccc(cc1)CN2CCCC23CC3 34a_100020620911_100015291786 [0,0,1,1,0,0|2,0,0]=4 2469 B16R3.6015 c1ccc(cc1)CN2C3CCC2CC3 2230a_100000735658_100015291786 [0,0,1,1,0,0|2,0,0]=4 2470 B16R3.6015 c1ccc(cc1)CN2C3CCC2CC3 269982a_100000735658_100000211182 [0,0,1,1,0,0|2,0,0]=4 2471 B16R3.6015 c1ccc(cc1)CN2C3CCC2CC3 270004a_100000735658_100015611070 [0,0,1,1,0,0|2,0,0]=4 2472 B16R3.6015 c1ccc(cc1)CN2C3CCC2CC3 34a_100000735658_100015291786 [0,0,1,1,0,0|2,0,0]=4 2473 B16R3.6015 c1ccc(cc1)NC2C3CCC2CC3 34a_100000106764_100009813300 [0,0,1,1,0,0|2,0,0]=4 2474 B16R3.6015 c1ccc(cc1)OC2C3CCC2CC3 34a_100000210340_100009813300 [0,0,1,1,0,0|2,0,0]=4 2475 B16R3.6015 c1ccc(cc1)SC2C3CCC2CC3 62a_100000719477_100009813300 [0,0,1,1,0,0|2,0,0]=4 2476 B16R3.6015 c1ccc(cc1)SC2C3CCC2CC3 62a_100009813300_100000041952 [0,0,1,1,0,0|2,0,0]=4 2477 B16R3.6018 c1ccc(cc1)CN2CC3CCC2C3 2230a_100000743476_100015291786 [0,0,1,1,0,0|2,0,0]=4 2478 B16R3.6018 c1ccc(cc1)CN2CC3CCC2C3 269982a_100000743476_100000211182 [0,0,1,1,0,0|2,0,0]=4 2479 B16R3.6018 c1ccc(cc1)CN2CC3CCC2C3 270004a_100000743476_100015611070 [0,0,1,1,0,0|2,0,0]=4 2480 B16R3.6018 c1ccc(cc1)CN2CC3CCC2C3 34a_100000743476_100015291786 [0,0,1,1,0,0|2,0,0]=4 2481 B16R3.6018 c1ccc(cc1)NC2CC3CCC2C3 34a_100000106764_100000727232 [0,0,1,1,0,0|2,0,0]=4 2482 B16R3.6018 c1ccc(cc1)OC2CC3CCC2C3 34a_100000210340_100000727232 [0,0,1,1,0,0|2,0,0]=4 2483 B16R3.6018 c1ccc(cc1)SC2CC3CCC2C3 62a_100000719477_100000727232 [0,0,1,1,0,0|2,0,0]=4 2484 B16R3.6018 c1ccc(cc1)SC2CC3CCC2C3 62a_100000727232_100000041952 [0,0,1,1,0,0|2,0,0]=4 2485 B16R3.8 c1ccc2c(c1)CCC2N3CCCC3 2230a_100000188435_200000721974 [0,0,1,1,0,0|2,0,0]=4 2486 B16R3.8 c1ccc2c(c1)CCC2N3CCCC3 269982a_100000188435_200000721974 [0,0,1,1,0,0|2,0,0]=4 2487 B16R3.2374 C[C@@H]1CCCN1C2Cc3c2cccc3 269982a_100015189458_100009813401 [0,0,1,1,0,0|2,0,0]=4 2488 B16R3.2374 C[C@H]1CCCN1C2Cc3c2cccc3 269982a_100020605311_100009813401 [0,0,1,1,0,0|2,0,0]=4 2489 B16R3.1777 c1ccc2c(c1)CC2OC3CCCC3 7a_100000210269_100009813401 [0,0,1,1,0,0|1,0,0]=3 2490 B16R3.1777 c1ccc2c(c1)CC2OC3CCSC3 7a_100011232664_100009813401 [0,0,1,1,0,0|2,0,0]=4 2491 B16R3.1777 c1ccc2c(c1)CC2SC3CCCC3 62a_100009813401_100000179811 [0,0,1,1,0,0|1,0,0]=3 2492 B16R3.1777 c1ccc2c(c1)CC2SC3CCCC3 62a_100011217020_100009813401 [0,0,1,1,0,0|1,0,0]=3 2493 B16R3.1777 c1ccc2c(c1)CC2SC3CCOC3 62a_100009813401_100000690089 [0,0,1,1,0,0|2,0,0]=4 2494 B14R2.35 CCCN1CCC1c2ccccc2 2230a_100000739605_100000210303 [0,0,1,0,1,0|2,0,0]=4 2495 B14R2.35 CCCN1CCC1c2ccccc2 269982a_100000739605_100000210303 [0,0,1,0,1,0|2,0,0]=4 2496 B14R2.41 CCCN1CC(C1)c2cccnc2 269982a_100015183634_100000210303 [0,0,1,0,1,0|2,0,0]=4 2497 B14R2.41 CCCN1CC(C1)c2ccncc2 269982a_100015185986_100000210303 [0,0,1,0,1,0|2,0,0]=4 2498 B14R2.41 CCNC1CC(C1)c2ccccc2 270004a_100015525214_100000741317 [0,0,1,0,1,0|1,0,0]=3 2499 B14R2.41 CCN[C@H]1C[C@H](C1)c2ccccc2 2230a_102125402554_100000210202 [0,0,1,0,1,0|1,0,0]=3 2500 B14R2.2850 CCN(c1ccccc1)C2CCC2 269982a_100000210013_100000749161 [0,0,1,0,1,0|2,0,0]=4 2501 B14R2.2850 CCN(c1ccccc1)C2CCC2 34a_100000210013_100000749161 [0,0,1,0,1,0|2,0,0]=4 2502 B14R2.2850 CNC(c1ccccc1)C2CCC2 269862a_106832991636_100011215208 [0,0,1,0,1,0|2,0,0]=4 2503 B14R2.2850 CN[C@@H](c1ccccc1)C2CCC2 2230a_100025717287_200000210301 [0,0,1,0,1,0|2,0,0]=4 2504 B14R2.2850 CN[C@@H](c1ccccc1)C2CCC2 34a_100025717287_200000210301 [0,0,1,0,1,0|2,0,0]=4 2505 B14R2.2850 [13CH3]N[C@@H](c1ccccc1)C2CCC2 2230a_100025717287_200025704644 [0,0,1,0,1,0|2,0,0]=4 2506 B14R2.2850 [13CH3]N[C@@H](c1ccccc1)C2CCC2 34a_100025717287_200025704644 [0,0,1,0,1,0|2,0,0]=4 2507 B14R2.335 CC1CCN1C(C)c2ccccc2 269982a_100000755817_100000230085 [0,0,1,0,1,0|2,0,0]=4 2508 B14R2.335 CC1CCN1C(C)c2ccccc2 34a_100000755817_100000211855 [0,0,1,0,1,0|2,0,0]=4 2509 B14R2.1253 C1=C(CCCCC1)c2ccccc2 271570a_200009888920_100000210277 [0,0,1,0,1,0|0,0,2]=4 2510 B14R2.101 C1=CCC(C1)NCc2ccccc2 207a_100015188752_100015611070 [0,0,1,0,1,0|0,0,2]=4 2511 B14R2.101 C1=CCC(C1)NCc2ccccc2 2230a_100015188752_100015291786 [0,0,1,0,1,0|0,0,2]=4 2512 B14R2.101 C1=CCC(C1)NCc2ccccc2 270004a_100015188752_100015611070 [0,0,1,0,1,0|0,0,2]=4 2513 B14R2.101 c1cc(ccn1)CCN2CCCC2 2230a_100000188435_100000723409 [0,0,1,0,1,0|2,0,0]=4 2514 B14R2.101 c1cc(ccn1)CCN2CCCC2 269982a_100000188435_100000723409 [0,0,1,0,1,0|2,0,0]=4 2515 B14R2.101 c1cc(ccn1)CNC2CCCC2 207a_100000211070_100000186114 [0,0,1,0,1,0|1,0,0]=3 2516 B14R2.101 c1cc(ccn1)CNC2CCCC2 2230a_100000211070_100015193705 [0,0,1,0,1,0|1,0,0]=3 2517 B14R2.101 c1cc(ccn1)CN[C@@H]2CCOC2 207a_200015188469_100000186114 [0,0,1,0,1,0|2,0,0]=4 2518 B14R2.101 c1cc(ccn1)CN[C@@H]2CCOC2 2230a_200015188469_100015193705 [0,0,1,0,1,0|2,0,0]=4 2519 B14R2.101 c1cc(ccn1)CN[C@H]2CCOC2 207a_100015188467_100000186114 [0,0,1,0,1,0|2,0,0]=4 2520 B14R2.101 c1cc(ccn1)CN[C@H]2CCOC2 2230a_100015188467_100015193705 [0,0,1,0,1,0|2,0,0]=4 2521 B14R2.101 c1cc(ccn1)COC2CCCC2 7a_100000210269_100015193705 [0,0,1,0,1,0|2,0,0]=4 2522 B14R2.101 c1cc(ccn1)CSC2CCCC2 62a_100011217020_100015193705 [0,0,1,0,1,0|2,0,0]=4 2523 B14R2.101 c1cc(ccn1)CSC2CCCC2 62a_100015193705_100000179811 [0,0,1,0,1,0|2,0,0]=4 2524 B14R2.101 c1cc(ccn1)OCC2CCCC2 34a_100000212176_100000740388 [0,0,1,0,1,0|2,0,0]=4 2525 B14R2.101 c1cc(ccn1)SCC2CCCC2 62a_100000728582_100000740388 [0,0,1,0,1,0|2,0,0]=4 2526 B14R2.101 c1cc(ccn1)SCC2CCCC2 62a_100000740388_100000728582 [0,0,1,0,1,0|2,0,0]=4 2527 B14R2.101 c1cc(cnn1)CNC2CCCC2 270004a_100000211070_100011934578 [0,0,1,0,1,0|2,0,0]=4 2528 B14R2.101 c1ccc(cc1)CCN2CCCC2 2230a_100000188435_100000765856 [0,0,1,0,1,0|1,0,0]=3 2529 B14R2.101 c1ccc(cc1)CCN2CCCC2 269982a_100000188435_100000765856 [0,0,1,0,1,0|1,0,0]=3 2530 B14R2.101 c1ccc(cc1)CCN2CCSC2 2230a_100011215254_100000765856 [0,0,1,0,1,0|2,0,0]=4 2531 B14R2.101 c1ccc(cc1)CCN2CCSC2 269982a_100011215254_100000765856 [0,0,1,0,1,0|2,0,0]=4 2532 B14R2.101 c1ccc(cc1)CNC2CCCC2 207a_100000211070_100015611070 [0,0,1,0,1,0|0,0,0]=2 2533 B14R2.101 c1ccc(cc1)CNC2CCCC2 2230a_100000211070_100015291786 [0,0,1,0,1,0|0,0,0]=2 2534 B14R2.101 c1ccc(cc1)CNC2CCCC2 2230a_100015324214_100000179811 [0,0,1,0,1,0|0,0,0]=2 2535 B14R2.101 c1ccc(cc1)CNC2CCCC2 270004a_100000211070_100015611070 [0,0,1,0,1,0|0,0,0]=2 2536 B14R2.101 c1ccc(cc1)CNC2CCCC2 270004a_100015324214_100000210133 [0,0,1,0,1,0|0,0,0]=2 2537 B14R2.101 c1ccc(cc1)CNC2CCCC2 34a_100000211070_100015291786 [0,0,1,0,1,0|0,0,0]=2 2538 B14R2.101 c1ccc(cc1)CNC2CCCC2 34a_100015324214_100000179811 [0,0,1,0,1,0|0,0,0]=2 2539 B14R2.101 c1ccc(cc1)CNC2CCOC2 2230a_100015324214_100000731011 [0,0,1,0,1,0|1,0,0]=3 2540 B14R2.101 c1ccc(cc1)CNC2CCOC2 270004a_100015324214_100000752484 [0,0,1,0,1,0|1,0,0]=3 2541 B14R2.101 c1ccc(cc1)CNC2CCOC2 34a_100015324214_100000690089 [0,0,1,0,1,0|1,0,0]=3 2542 B14R2.101 c1ccc(cc1)CNC2CCSC2 270004a_100015324214_100000212027 [0,0,1,0,1,0|1,0,0]=3 2543 B14R2.101 c1ccc(cc1)CN[C@@H]2CCOC2 207a_200015188469_100015611070 [0,0,1,0,1,0|1,0,0]=3 2544 B14R2.101 c1ccc(cc1)CN[C@@H]2CCOC2 2230a_200015188469_100015291786 [0,0,1,0,1,0|1,0,0]=3 2545 B14R2.101 c1ccc(cc1)CN[C@@H]2CCOC2 270004a_200015188469_100015611070 [0,0,1,0,1,0|1,0,0]=3 2546 B14R2.101 c1ccc(cc1)CN[C@H]2CCOC2 207a_100015188467_100015611070 [0,0,1,0,1,0|1,0,0]=3 2547 B14R2.101 c1ccc(cc1)CN[C@H]2CCOC2 2230a_100015188467_100015291786 [0,0,1,0,1,0|1,0,0]=3 2548 B14R2.101 c1ccc(cc1)CN[C@H]2CCOC2 270004a_100015188467_100015611070 [0,0,1,0,1,0|1,0,0]=3 2549 B14R2.101 c1ccc(cc1)CN[C@H]2CCOC2 34a_100015188467_100015291786 [0,0,1,0,1,0|1,0,0]=3 2550 B14R2.101 c1ccc(cc1)COC2CCCC2 34a_100000210269_100015291786 [0,0,1,0,1,0|1,0,0]=3 2551 B14R2.101 c1ccc(cc1)COC2CCCC2 34a_100000210790_100000179811 [0,0,1,0,1,0|1,0,0]=3 2552 B14R2.101 c1ccc(cc1)COC2CCCC2 7a_100000210269_100000211182 [0,0,1,0,1,0|1,0,0]=3 2553 B14R2.101 c1ccc(cc1)COC2CCCC2 7a_100000210790_100000179811 [0,0,1,0,1,0|1,0,0]=3 2554 B14R2.101 c1ccc(cc1)COC2CCCO2 34a_100000085407_100015291786 [0,0,1,0,1,0|2,0,0]=4 2555 B14R2.101 c1ccc(cc1)COC2CCOC2 34a_100000210790_100000690089 [0,0,1,0,1,0|2,0,0]=4 2556 B14R2.101 c1ccc(cc1)COC2CCOC2 7a_100000210790_100000731011 [0,0,1,0,1,0|2,0,0]=4 2557 B14R2.101 c1ccc(cc1)COC2CCSC2 7a_100011232664_100000211182 [0,0,1,0,1,0|2,0,0]=4 2558 B14R2.101 c1ccc(cc1)CO[C@H]2CCOC2 34a_100000717292_100015291786 [0,0,1,0,1,0|2,0,0]=4 2559 B14R2.101 c1ccc(cc1)CSC2CCCC2 62a_100000211182_100000179811 [0,0,1,0,1,0|1,0,0]=3 2560 B14R2.101 c1ccc(cc1)CSC2CCCC2 62a_100011217020_100015291786 [0,0,1,0,1,0|1,0,0]=3 2561 B14R2.101 c1ccc(cc1)CSC2CCOC2 62a_100000211182_100000690089 [0,0,1,0,1,0|2,0,0]=4 2562 B14R2.101 c1ccc(cc1)NCC2CCCC2 34a_100000106764_100000740388 [0,0,1,0,1,0|1,0,0]=3 2563 B14R2.101 c1ccc(cc1)NCC2CCOC2 34a_100000106764_100011261433 [0,0,1,0,1,0|2,0,0]=4 2564 B14R2.101 c1ccc(cc1)OCC2CCCC2 34a_100000210340_100000740388 [0,0,1,0,1,0|1,0,0]=3 2565 B14R2.101 c1ccc(cc1)OCC2CCCC2 7a_100000210340_100000740388 [0,0,1,0,1,0|1,0,0]=3 2566 B14R2.101 c1ccc(cc1)OCC2CCCO2 7a_100000210340_100000203698 [0,0,1,0,1,0|2,0,0]=4 2567 B14R2.101 c1ccc(cc1)OCC2CCOC2 34a_100000210340_100011261433 [0,0,1,0,1,0|2,0,0]=4 2568 B14R2.101 c1ccc(cc1)OCC2CCOC2 7a_100000210340_100000702531 [0,0,1,0,1,0|2,0,0]=4 2569 B14R2.101 c1ccc(cc1)SCC2CCCC2 62a_100000719477_100000740388 [0,0,1,0,1,0|1,0,0]=3 2570 B14R2.101 c1ccc(cc1)SCC2CCCC2 62a_100000740388_100000041952 [0,0,1,0,1,0|1,0,0]=3 2571 B14R2.101 c1ccc(cc1)SCC2CCCO2 62a_100000203698_100000041952 [0,0,1,0,1,0|2,0,0]=4 2572 B14R2.101 c1ccc(cc1)SCC2CCCO2 62a_100000719477_100000203698 [0,0,1,0,1,0|2,0,0]=4 2573 B14R2.101 c1ccc(cc1)SCC2CCOC2 62a_100000702531_100000041952 [0,0,1,0,1,0|2,0,0]=4 2574 B14R2.101 c1ccc(cc1)SCC2CCOC2 62a_100000719477_100000702531 [0,0,1,0,1,0|2,0,0]=4 2575 B14R2.101 c1ccc(cc1)SCN2CCCC2 2230a_100000188435_100011218342 [0,0,1,0,1,0|2,0,0]=4 2576 B14R2.101 c1ccc(cc1)SCN2CCCC2 269982a_100000188435_100011218342 [0,0,1,0,1,0|2,0,0]=4 2577 B14R2.101 c1ccc(nc1)CCN2CCCC2 2230a_100000188435_100015183660 [0,0,1,0,1,0|2,0,0]=4 2578 B14R2.101 c1ccc(nc1)CCN2CCCC2 269982a_100000188435_100015183660 [0,0,1,0,1,0|2,0,0]=4 2579 B14R2.101 c1ccc(nc1)CNC2CCCC2 207a_100000211070_100000209966 [0,0,1,0,1,0|1,0,0]=3 2580 B14R2.101 c1ccc(nc1)CNC2CCCC2 2230a_100000211070_100000721315 [0,0,1,0,1,0|1,0,0]=3 2581 B14R2.101 c1ccc(nc1)CNC2CCCC2 270004a_100000210449_100000210133 [0,0,1,0,1,0|1,0,0]=3 2582 B14R2.101 c1ccc(nc1)CNC2CCCC2 270004a_100000211070_100000209966 [0,0,1,0,1,0|1,0,0]=3 2583 B14R2.101 c1ccc(nc1)CNC2CCCC2 34a_100000211070_100000721315 [0,0,1,0,1,0|1,0,0]=3 2584 B14R2.101 c1ccc(nc1)CNC2CCOC2 270004a_100000210449_100000752484 [0,0,1,0,1,0|2,0,0]=4 2585 B14R2.101 c1ccc(nc1)CNC2CCSC2 270004a_100000210449_100000212027 [0,0,1,0,1,0|2,0,0]=4 2586 B14R2.101 c1ccc(nc1)CN[C@@H]2CCOC2 207a_200015188469_100000209966 [0,0,1,0,1,0|2,0,0]=4 2587 B14R2.101 c1ccc(nc1)CN[C@@H]2CCOC2 2230a_200015188469_100000721315 [0,0,1,0,1,0|2,0,0]=4 2588 B14R2.101 c1ccc(nc1)CN[C@@H]2CCOC2 270004a_200015188469_100000209966 [0,0,1,0,1,0|2,0,0]=4 2589 B14R2.101 c1ccc(nc1)CN[C@H]2CCOC2 207a_100015188467_100000209966 [0,0,1,0,1,0|2,0,0]=4 2590 B14R2.101 c1ccc(nc1)CN[C@H]2CCOC2 2230a_100015188467_100000721315 [0,0,1,0,1,0|2,0,0]=4 2591 B14R2.101 c1ccc(nc1)CN[C@H]2CCOC2 270004a_100015188467_100000209966 [0,0,1,0,1,0|2,0,0]=4 2592 B14R2.101 c1ccc(nc1)CN[C@H]2CCOC2 34a_100015188467_100000721315 [0,0,1,0,1,0|2,0,0]=4 2593 B14R2.101 c1ccc(nc1)COC2CCCC2 34a_100000210269_100000721315 [0,0,1,0,1,0|2,0,0]=4 2594 B14R2.101 c1ccc(nc1)COC2CCCC2 7a_100000210269_100000721315 [0,0,1,0,1,0|2,0,0]=4 2595 B14R2.101 c1ccc(nc1)CSC2CCCC2 62a_100000721315_100000179811 [0,0,1,0,1,0|2,0,0]=4 2596 B14R2.101 c1ccc(nc1)CSC2CCCC2 62a_100011217020_100000721315 [0,0,1,0,1,0|2,0,0]=4 2597 B14R2.101 c1ccc(nc1)SCC2CCCC2 62a_100000740388_100011216584 [0,0,1,0,1,0|2,0,0]=4 2598 B14R2.101 c1ccc(nc1)SCC2CCCC2 62a_100011216584_100000740388 [0,0,1,0,1,0|2,0,0]=4 2599 B14R2.101 c1cnc(cn1)CNC2CCCC2 2230a_100000211070_100016995436 [0,0,1,0,1,0|2,0,0]=4 2600 B14R2.101 c1cnc(cn1)CNC2CCCC2 270004a_100000211070_100000749867 [0,0,1,0,1,0|2,0,0]=4 2601 B14R2.101 c1cnc(cn1)CNC2CCCC2 34a_100000211070_100016995436 [0,0,1,0,1,0|2,0,0]=4 2602 B14R2.101 c1cnc(nc1)CNC2CCCC2 2230a_100000211070_100000703007 [0,0,1,0,1,0|2,0,0]=4 2603 B14R2.101 c1cnc(nc1)CNC2CCCC2 270004a_100000211070_100011532527 [0,0,1,0,1,0|2,0,0]=4 2604 B14R2.101 c1cnc(nc1)CNC2CCCC2 34a_100000211070_100000703007 [0,0,1,0,1,0|2,0,0]=4 2605 B14R2.101 c1cncc(c1)CCN2CCCC2 2230a_100000188435_200011713674 [0,0,1,0,1,0|2,0,0]=4 2606 B14R2.101 c1cncc(c1)CCN2CCCC2 269982a_100000188435_200011713674 [0,0,1,0,1,0|2,0,0]=4 2607 B14R2.101 c1cncc(c1)CNC2CCCC2 207a_100000211070_100000209961 [0,0,1,0,1,0|1,0,0]=3 2608 B14R2.101 c1cncc(c1)CNC2CCCC2 2230a_100000211070_100000741622 [0,0,1,0,1,0|1,0,0]=3 2609 B14R2.101 c1cncc(c1)CNC2CCCC2 270004a_100000210453_100000210133 [0,0,1,0,1,0|1,0,0]=3 2610 B14R2.101 c1cncc(c1)CNC2CCCC2 270004a_100000211070_100000209961 [0,0,1,0,1,0|1,0,0]=3 2611 B14R2.101 c1cncc(c1)CNC2CCCC2 34a_100000211070_100000733263 [0,0,1,0,1,0|1,0,0]=3 2612 B14R2.101 c1cncc(c1)CNC2CCOC2 270004a_100000210453_100000752484 [0,0,1,0,1,0|2,0,0]=4 2613 B14R2.101 c1cncc(c1)CNC2CCSC2 270004a_100000210453_100000212027 [0,0,1,0,1,0|2,0,0]=4 2614 B14R2.101 c1cncc(c1)CN[C@@H]2CCOC2 207a_200015188469_100000209961 [0,0,1,0,1,0|2,0,0]=4 2615 B14R2.101 c1cncc(c1)CN[C@@H]2CCOC2 2230a_200015188469_100000741622 [0,0,1,0,1,0|2,0,0]=4 2616 B14R2.101 c1cncc(c1)CN[C@@H]2CCOC2 270004a_200015188469_100000209961 [0,0,1,0,1,0|2,0,0]=4 2617 B14R2.101 c1cncc(c1)CN[C@H]2CCOC2 207a_100015188467_100000209961 [0,0,1,0,1,0|2,0,0]=4 2618 B14R2.101 c1cncc(c1)CN[C@H]2CCOC2 2230a_100015188467_100000741622 [0,0,1,0,1,0|2,0,0]=4 2619 B14R2.101 c1cncc(c1)CN[C@H]2CCOC2 270004a_100015188467_100000209961 [0,0,1,0,1,0|2,0,0]=4 2620 B14R2.101 c1cncc(c1)CN[C@H]2CCOC2 34a_100015188467_100000733263 [0,0,1,0,1,0|2,0,0]=4 2621 B14R2.101 c1cncc(c1)COC2CCCC2 34a_100000210269_100000733263 [0,0,1,0,1,0|2,0,0]=4 2622 B14R2.101 c1cncc(c1)COC2CCCC2 7a_100000210269_100000741622 [0,0,1,0,1,0|2,0,0]=4 2623 B14R2.101 c1cncc(c1)CSC2CCCC2 62a_100000741622_100000179811 [0,0,1,0,1,0|2,0,0]=4 2624 B14R2.101 c1cncc(c1)CSC2CCCC2 62a_100011217020_100000741622 [0,0,1,0,1,0|2,0,0]=4 2625 B14R2.101 c1cncc(c1)OCC2CCCC2 34a_100000210849_100000740388 [0,0,1,0,1,0|2,0,0]=4 2626 B14R2.101 c1cncc(c1)OCC2CCCC2 7a_100000210849_100000740388 [0,0,1,0,1,0|2,0,0]=4 2627 B14R2.101 c1cncc(c1)SCC2CCCC2 62a_100000210063_100000740388 [0,0,1,0,1,0|2,0,0]=4 2628 B14R2.101 c1cncc(c1)SCC2CCCC2 62a_100000740388_100000210063 [0,0,1,0,1,0|2,0,0]=4 2629 B14R2.101 c1cnnc(c1)CNC2CCCC2 2230a_100000211070_100016990269 [0,0,1,0,1,0|2,0,0]=4 2630 B14R2.101 c1cnnc(c1)CNC2CCCC2 2230a_100159270163_100000179811 [0,0,1,0,1,0|2,0,0]=4 2631 B14R2.101 c1cnnc(c1)CNC2CCCC2 34a_100000211070_100016990269 [0,0,1,0,1,0|2,0,0]=4 2632 B14R2.101 c1ncc(cn1)CNC2CCCC2 2230a_100000211070_100015196519 [0,0,1,0,1,0|2,0,0]=4 2633 B14R2.101 c1ncc(cn1)CNC2CCCC2 2230a_100011243677_100000179811 [0,0,1,0,1,0|2,0,0]=4 2634 B14R2.101 c1ncc(cn1)CNC2CCCC2 270004a_100000211070_100000749868 [0,0,1,0,1,0|2,0,0]=4 2635 B14R2.101 c1ncc(cn1)CNC2CCCC2 270004a_100011243677_100000210133 [0,0,1,0,1,0|2,0,0]=4 2636 B14R2.101 c1ncc(cn1)CNC2CCCC2 34a_100000211070_100015196519 [0,0,1,0,1,0|2,0,0]=4 2637 B14R2.322 c1c[nH]c(n1)CCNC2CCCC2 270004a_100000754300_100000210133 [0,0,1,0,1,0|2,0,0]=4 2638 B14R2.322 c1cc(cs1)CCNC2CCCC2 2230a_100000692642_100000179811 [0,0,1,0,1,0|1,0,0]=3 2639 B14R2.322 c1cc(cs1)CCNC2CCCC2 270004a_100000692642_100000210133 [0,0,1,0,1,0|1,0,0]=3 2640 B14R2.322 c1cc(cs1)CCNC2CCCC2 34a_100000692642_100000179811 [0,0,1,0,1,0|1,0,0]=3 2641 B14R2.322 c1cc(cs1)CCNC2CCOC2 2230a_100000692642_100000731011 [0,0,1,0,1,0|2,0,0]=4 2642 B14R2.322 c1cc(cs1)CCNC2CCOC2 270004a_100000692642_100000752484 [0,0,1,0,1,0|2,0,0]=4 2643 B14R2.322 c1cc(cs1)CCNC2CCOC2 34a_100000692642_100000690089 [0,0,1,0,1,0|2,0,0]=4 2644 B14R2.322 c1cc(cs1)CCNC2CCSC2 270004a_100000692642_100000212027 [0,0,1,0,1,0|2,0,0]=4 2645 B14R2.322 c1cc(cs1)CCOC2CCCC2 34a_100000748821_100000179811 [0,0,1,0,1,0|2,0,0]=4 2646 B14R2.322 c1ccn(c1)CCNC2CCCC2 2230a_100000211070_200009811947 [0,0,1,0,1,0|1,0,0]=3 2647 B14R2.322 c1ccn(c1)CCNC2CCCC2 270004a_100011368172_100000210133 [0,0,1,0,1,0|1,0,0]=3 2648 B14R2.322 c1ccn(c1)CCNC2CCCC2 34a_100011368172_100000179811 [0,0,1,0,1,0|1,0,0]=3 2649 B14R2.322 c1ccn(c1)CCNC2CCOC2 270004a_100011368172_100000752484 [0,0,1,0,1,0|2,0,0]=4 2650 B14R2.322 c1ccn(c1)CCNC2CCOC2 34a_100011368172_100000690089 [0,0,1,0,1,0|2,0,0]=4 2651 B14R2.322 c1ccn(c1)CCNC2CCSC2 270004a_100011368172_100000212027 [0,0,1,0,1,0|2,0,0]=4 2652 B14R2.322 c1ccn(c1)CCN[C@@H]2CCOC2 2230a_200015188469_200009811947 [0,0,1,0,1,0|2,0,0]=4 2653 B14R2.322 c1ccn(c1)CCN[C@H]2CCOC2 2230a_100015188467_200009811947 [0,0,1,0,1,0|2,0,0]=4 2654 B14R2.322 c1ccn(c1)CCOC2CCCC2 34a_100000179382_100000179811 [0,0,1,0,1,0|2,0,0]=4 2655 B14R2.322 c1ccn(c1)CCOC2CCCC2 7a_100000210269_200000035178 [0,0,1,0,1,0|2,0,0]=4 2656 B14R2.322 c1ccn(c1)CCSC2CCCC2 62a_100011217020_200000035178 [0,0,1,0,1,0|2,0,0]=4 2657 B14R2.322 c1ccn(c1)CCSC2CCCC2 62a_200009811947_100000179811 [0,0,1,0,1,0|2,0,0]=4 2658 B14R2.322 c1cn(cn1)CCNC2CCCC2 270004a_100000230061_100000210133 [0,0,1,0,1,0|2,0,0]=4 2659 B14R2.322 c1cnn(c1)CCNC2CCCC2 2230a_100000211070_100000685285 [0,0,1,0,1,0|2,0,0]=4 2660 B14R2.322 c1cnn(c1)CCNC2CCCC2 2230a_100011200920_100000179811 [0,0,1,0,1,0|2,0,0]=4 2661 B14R2.322 c1cnn(c1)CCNC2CCCC2 270004a_100011200920_100000210133 [0,0,1,0,1,0|2,0,0]=4 2662 B14R2.322 c1cnn(c1)CCNC2CCCC2 34a_100000211070_100015204718 [0,0,1,0,1,0|2,0,0]=4 2663 B14R2.322 c1coc(c1)CCNC2CCCC2 2230a_100000694680_100000179811 [0,0,1,0,1,0|1,0,0]=3 2664 B14R2.322 c1coc(c1)CCNC2CCCC2 270004a_100000694680_100000210133 [0,0,1,0,1,0|1,0,0]=3 2665 B14R2.322 c1coc(c1)CCNC2CCCC2 34a_100000694680_100000179811 [0,0,1,0,1,0|1,0,0]=3 2666 B14R2.322 c1coc(c1)CCNC2CCOC2 2230a_100000694680_100000731011 [0,0,1,0,1,0|2,0,0]=4 2667 B14R2.322 c1coc(c1)CCNC2CCOC2 270004a_100000694680_100000752484 [0,0,1,0,1,0|2,0,0]=4 2668 B14R2.322 c1coc(c1)CCNC2CCOC2 34a_100000694680_100000690089 [0,0,1,0,1,0|2,0,0]=4 2669 B14R2.322 c1coc(c1)CCNC2CCSC2 270004a_100000694680_100000212027 [0,0,1,0,1,0|2,0,0]=4 2670 B14R2.322 c1csc(c1)CCNC2CCCC2 2230a_100000203755_100000179811 [0,0,1,0,1,0|1,0,0]=3 2671 B14R2.322 c1csc(c1)CCNC2CCCC2 2230a_100000211070_100000748579 [0,0,1,0,1,0|1,0,0]=3 2672 B14R2.322 c1csc(c1)CCNC2CCCC2 270004a_100000203755_100000210133 [0,0,1,0,1,0|1,0,0]=3 2673 B14R2.322 c1csc(c1)CCNC2CCCC2 34a_100000203755_100000179811 [0,0,1,0,1,0|1,0,0]=3 2674 B14R2.322 c1csc(c1)CCNC2CCCC2 34a_100000211070_100000748579 [0,0,1,0,1,0|1,0,0]=3 2675 B14R2.322 c1csc(c1)CCNC2CCOC2 2230a_100000203755_100000731011 [0,0,1,0,1,0|2,0,0]=4 2676 B14R2.322 c1csc(c1)CCNC2CCOC2 270004a_100000203755_100000752484 [0,0,1,0,1,0|2,0,0]=4 2677 B14R2.322 c1csc(c1)CCNC2CCOC2 34a_100000203755_100000690089 [0,0,1,0,1,0|2,0,0]=4 2678 B14R2.322 c1csc(c1)CCNC2CCSC2 270004a_100000203755_100000212027 [0,0,1,0,1,0|2,0,0]=4 2679 B14R2.322 c1csc(c1)CCN[C@@H]2CCOC2 2230a_200015188469_100000748579 [0,0,1,0,1,0|2,0,0]=4 2680 B14R2.322 c1csc(c1)CCN[C@H]2CCOC2 2230a_100015188467_100000748579 [0,0,1,0,1,0|2,0,0]=4 2681 B14R2.322 c1csc(c1)CCN[C@H]2CCOC2 34a_100015188467_100000748579 [0,0,1,0,1,0|2,0,0]=4 2682 B14R2.322 c1csc(c1)CCOC2CCCC2 34a_100000210269_100000748579 [0,0,1,0,1,0|2,0,0]=4 2683 B14R2.322 c1csc(c1)CCOC2CCCC2 34a_100011216825_100000179811 [0,0,1,0,1,0|2,0,0]=4 2684 B14R2.322 c1csc(c1)CCOC2CCCC2 7a_100000210269_100000748579 [0,0,1,0,1,0|2,0,0]=4 2685 B14R2.322 c1csc(c1)CCOC2CCCC2 7a_100011216825_100000179811 [0,0,1,0,1,0|2,0,0]=4 2686 B14R2.322 c1csc(c1)CCSC2CCCC2 62a_100000748579_100000179811 [0,0,1,0,1,0|2,0,0]=4 2687 B14R2.322 c1csc(c1)CCSC2CCCC2 62a_100011217020_100000748579 [0,0,1,0,1,0|2,0,0]=4 2688 B14R2.322 c1csc(n1)CCNC2CCCC2 2230a_100015186391_100000179811 [0,0,1,0,1,0|2,0,0]=4 2689 B14R2.322 c1csc(n1)CCNC2CCCC2 270004a_100015186391_100000210133 [0,0,1,0,1,0|2,0,0]=4 2690 B14R2.322 c1n[nH]cc1CCNC2CCCC2 2230a_100000211070_100000743252 [0,0,1,0,1,0|2,0,0]=4 2691 B14R2.322 c1n[nH]cc1CCNC2CCCC2 2230a_100000732747_100000179811 [0,0,1,0,1,0|2,0,0]=4 2692 B14R2.322 c1n[nH]cc1CCNC2CCCC2 270004a_100000732747_100000210133 [0,0,1,0,1,0|2,0,0]=4 2693 B14R2.322 c1nc(c[nH]1)CCNC2CCCC2 2230a_100000211070_100020628418 [0,0,1,0,1,0|2,0,0]=4 2694 B14R2.322 c1nc(c[nH]1)CCNC2CCCC2 270004a_100000755092_100000210133 [0,0,1,0,1,0|2,0,0]=4 2695 B14R2.322 c1ncc(s1)CCNC2CCCC2 2230a_100016991637_100000179811 [0,0,1,0,1,0|2,0,0]=4 2696 B14R2.322 c1ncc(s1)CCNC2CCCC2 270004a_100016991637_100000210133 [0,0,1,0,1,0|2,0,0]=4 2697 B14R2.3019 C(=NNC1CCC1)c2ccccc2 4a_100000736358_100015611070 [0,0,1,0,1,0|1,0,1]=4 2698 B14R2.3019 c1cc(ccn1)CCNC2CCC2 2230a_100000749019_100000723409 [0,0,1,0,1,0|1,0,0]=3 2699 B14R2.3019 c1cc(ccn1)CCNC2CCC2 270004a_100000742849_100000241760 [0,0,1,0,1,0|1,0,0]=3 2700 B14R2.3019 c1cc(ccn1)CCNC2COC2 2230a_100016991112_100000723409 [0,0,1,0,1,0|2,0,0]=4 2701 B14R2.3019 c1cc(ccn1)CCOC2CCC2 34a_100011216225_100000749161 [0,0,1,0,1,0|2,0,0]=4 2702 B14R2.3019 c1cc(ccn1)CCSC2CCC2 62a_100000723409_100000749161 [0,0,1,0,1,0|2,0,0]=4 2703 B14R2.3019 c1ccc(cc1)CCCN2CCC2 269982a_100000754969_100000211621 [0,0,1,0,1,0|2,0,0]=4 2704 B14R2.3019 c1ccc(cc1)CCNC2CCC2 2230a_100000749019_100000765856 [0,0,1,0,1,0|0,0,0]=2 2705 B14R2.3019 c1ccc(cc1)CCNC2CCC2 270004a_100000106460_100000241760 [0,0,1,0,1,0|0,0,0]=2 2706 B14R2.3019 c1ccc(cc1)CCNC2CCC2 34a_100000106460_100000749161 [0,0,1,0,1,0|0,0,0]=2 2707 B14R2.3019 c1ccc(cc1)CCNC2CCC2 34a_100000749019_100000765856 [0,0,1,0,1,0|0,0,0]=2 2708 B14R2.3019 c1ccc(cc1)CCNC2COC2 2230a_100016991112_100000765856 [0,0,1,0,1,0|1,0,0]=3 2709 B14R2.3019 c1ccc(cc1)CCNC2COC2 34a_100000106460_100009818527 [0,0,1,0,1,0|1,0,0]=3 2710 B14R2.3019 c1ccc(cc1)CCOC2CCC2 34a_100000210268_100000749161 [0,0,1,0,1,0|1,0,0]=3 2711 B14R2.3019 c1ccc(cc1)CCOC2CCC2 34a_100000748187_100000765856 [0,0,1,0,1,0|1,0,0]=3 2712 B14R2.3019 c1ccc(cc1)CCOC2COC2 34a_100000210268_100009818527 [0,0,1,0,1,0|2,0,0]=4 2713 B14R2.3019 c1ccc(cc1)CCOC2COC2 7a_100000210268_100009818527 [0,0,1,0,1,0|2,0,0]=4 2714 B14R2.3019 c1ccc(cc1)CCOC2CSC2 7a_100000072292_100000765856 [0,0,1,0,1,0|2,0,0]=4 2715 B14R2.3019 c1ccc(cc1)CCSC2CCC2 62a_100000765856_100000749161 [0,0,1,0,1,0|1,0,0]=3 2716 B14R2.3019 c1ccc(cc1)CCSC2COC2 62a_100000765856_100009818527 [0,0,1,0,1,0|2,0,0]=4 2717 B14R2.3019 c1ccc(cc1)CNCC2CCC2 207a_100000738700_100015611070 [0,0,1,0,1,0|2,0,0]=4 2718 B14R2.3019 c1ccc(cc1)CNCC2CCC2 2230a_100000738700_100015291786 [0,0,1,0,1,0|2,0,0]=4 2719 B14R2.3019 c1ccc(cc1)CNCC2CCC2 2230a_100015324214_100000763275 [0,0,1,0,1,0|2,0,0]=4 2720 B14R2.3019 c1ccc(cc1)CNCC2CCC2 269862a_100015324214_100000753134 [0,0,1,0,1,0|2,0,0]=4 2721 B14R2.3019 c1ccc(cc1)CNCC2CCC2 270004a_100000738700_100015611070 [0,0,1,0,1,0|2,0,0]=4 2722 B14R2.3019 c1ccc(cc1)CNCC2CCC2 34a_100000738700_100015291786 [0,0,1,0,1,0|2,0,0]=4 2723 B14R2.3019 c1ccc(cc1)CNCC2CCC2 34a_100015324214_100000763275 [0,0,1,0,1,0|2,0,0]=4 2724 B14R2.3019 c1ccc(cc1)COCC2CCC2 34a_100000210790_100000763275 [0,0,1,0,1,0|2,0,0]=4 2725 B14R2.3019 c1ccc(cc1)COCC2CCC2 34a_100000760304_100015291786 [0,0,1,0,1,0|2,0,0]=4 2726 B14R2.3019 c1ccc(cc1)COCC2CCC2 7a_100000210790_100000763275 [0,0,1,0,1,0|2,0,0]=4 2727 B14R2.3019 c1ccc(cc1)CSCC2CCC2 62a_100000211182_100000763275 [0,0,1,0,1,0|2,0,0]=4 2728 B14R2.3019 c1ccc(cc1)CSCC2CCC2 62a_100000763275_100015291786 [0,0,1,0,1,0|2,0,0]=4 2729 B14R2.3019 c1ccc(cc1)SCNC2CCC2 2230a_100000749019_100011218342 [0,0,1,0,1,0|1,0,0]=3 2730 B14R2.3019 c1ccc(cc1)SCNC2COC2 2230a_100016991112_100011218342 [0,0,1,0,1,0|2,0,0]=4 2731 B14R2.3019 c1ccc(cc1)SCSC2CCC2 62a_100011218342_100000749161 [0,0,1,0,1,0|2,0,0]=4 2732 B14R2.3019 c1ccc(nc1)CCNC2CCC2 2230a_100000749019_100015183660 [0,0,1,0,1,0|1,0,0]=3 2733 B14R2.3019 c1ccc(nc1)CCNC2CCC2 270004a_100000211156_100000241760 [0,0,1,0,1,0|1,0,0]=3 2734 B14R2.3019 c1ccc(nc1)CCNC2COC2 2230a_100016991112_100015183660 [0,0,1,0,1,0|2,0,0]=4 2735 B14R2.3019 c1ccc(nc1)CCOC2CCC2 34a_100000210271_100000749161 [0,0,1,0,1,0|2,0,0]=4 2736 B14R2.3019 c1ccc(nc1)CCSC2CCC2 62a_100015183660_100000749161 [0,0,1,0,1,0|2,0,0]=4 2737 B14R2.3019 c1cnc(cn1)CCNC2CCC2 270004a_100000723456_100000241760 [0,0,1,0,1,0|2,0,0]=4 2738 B14R2.3019 c1cncc(c1)CCNC2CCC2 2230a_100000749019_200011713674 [0,0,1,0,1,0|1,0,0]=3 2739 B14R2.3019 c1cncc(c1)CCNC2CCC2 270004a_100000736294_100000241760 [0,0,1,0,1,0|1,0,0]=3 2740 B14R2.3019 c1cncc(c1)CCNC2COC2 2230a_100016991112_200011713674 [0,0,1,0,1,0|2,0,0]=4 2741 B14R2.3019 c1cncc(c1)CCOC2CCC2 34a_100011217484_100000749161 [0,0,1,0,1,0|2,0,0]=4 2742 B14R2.3019 c1cncc(c1)CCSC2CCC2 62a_200011713674_100000749161 [0,0,1,0,1,0|2,0,0]=4 2743 B16R2.7 CCCC1CC=C(CC1)c2ccccc2 271570a_200000119039_100000210277 [0,0,1,0,0,1|1,0,1]=4 2744 B16R2.7 CCCN1CCC(CC1)c2ccccc2 2230a_100000736203_100000210303 [0,0,1,0,0,1|2,0,0]=4 2745 B16R2.7 CCCN1CCC(CC1)c2ccccc2 269982a_100000736203_100000210303 [0,0,1,0,0,1|2,0,0]=4 2746 B16R2.7 CCCN1CCC(CC1)c2ccccc2 34a_100000736203_100000210303 [0,0,1,0,0,1|2,0,0]=4 2747 B16R2.7 CCNC1CCC(CC1)c2ccccc2 270004a_100015525214_100000184041 [0,0,1,0,0,1|2,0,0]=4 2748 B16R2.7 CCNC1CCC(CC1)c2ccccc2 34a_100000737527_100000210202 [0,0,1,0,0,1|2,0,0]=4 2749 B16R2.7 CCO[C@H]1CC[C@H](CC1)c2ccccc2 34a_100116294895_100000210202 [0,0,1,0,0,1|2,0,0]=4 2750 B16R2.7 CCO[C@H]1CC[C@H](CC1)c2ccccc2 7a_100116294895_100000210202 [0,0,1,0,0,1|2,0,0]=4 2751 B16R2.7 COCC1CCC(CC1)c2ccccc2 34a_200000186167_200000210301 [0,0,1,0,0,1|2,0,0]=4 2752 B16R2.7 COCC1CCC(CC1)c2ccccc2 7a_200000186167_200000210301 [0,0,1,0,0,1|2,0,0]=4 2753 B16R2.7 [13CH3]OCC1CCC(CC1)c2ccccc2 34a_200000186167_200025704644 [0,0,1,0,0,1|2,0,0]=4 2754 B16R2.7 [13CH3]OCC1CCC(CC1)c2ccccc2 7a_200000186167_200025704644 [0,0,1,0,0,1|2,0,0]=4 2755 B16R2.92 CCCN1CCC(C1)Oc2ccccc2 2230a_200015184049_100000210303 [0,0,1,0,0,1|2,0,0]=4 2756 B16R2.92 CCCN1CCC(C1)Oc2ccccc2 269982a_200015184049_100000210303 [0,0,1,0,0,1|2,0,0]=4 2757 B16R2.94 CCCN1CCCC(C1)c2ccccc2 2230a_100011236195_100000210303 [0,0,1,0,0,1|2,0,0]=4 2758 B16R2.94 CCCN1CCCC(C1)c2ccccc2 269982a_100011236195_100000210303 [0,0,1,0,0,1|2,0,0]=4 2759 B16R2.94 CCCN1CCCC(C1)c2ccccc2 34a_100011236195_100000210303 [0,0,1,0,0,1|2,0,0]=4 2760 B16R2.94 CCCN1CCO[C@H](C1)c2ccccc2 2230a_100009815478_100000210303 [0,0,1,0,0,1|2,0,0]=4 2761 B16R2.94 CCCN1CCO[C@H](C1)c2ccccc2 269982a_100009815478_100000210303 [0,0,1,0,0,1|2,0,0]=4 2762 B16R2.94 CCCN1CCO[C@H](C1)c2ccccc2 34a_100009815478_100000210303 [0,0,1,0,0,1|2,0,0]=4 2763 B16R2.94 CCNC1CCCC(C1)c2ccccc2 270004a_100015525214_100000718469 [0,0,1,0,0,1|2,0,0]=4 2764 B16R2.94 CCNC1CCOC(C1)c2ccccc2 270004a_100015525214_100011986434 [0,0,1,0,0,1|2,0,0]=4 2765 B16R2.94 CCOC1CCOC(C1)c2ccccc2 34a_100000692292_100000210202 [0,0,1,0,0,1|2,0,0]=4 2766 B16R2.94 CCOC1CCOC(C1)c2ccccc2 7a_100000692292_100000210202 [0,0,1,0,0,1|2,0,0]=4 2767 B16R2.98 CCCN1CCCCC1c2ccccc2 2230a_100000707174_100000210303 [0,0,1,0,0,1|2,0,0]=4 2768 B16R2.98 CCCN1CCCCC1c2ccccc2 269982a_100000707174_100000210303 [0,0,1,0,0,1|2,0,0]=4 2769 B16R2.98 CCCN1CCCCC1c2ccccc2 34a_100000707174_100000210303 [0,0,1,0,0,1|2,0,0]=4 2770 B16R2.98 CCCN1CCOCC1c2ccccc2 2230a_100000765270_100000210303 [0,0,1,0,0,1|2,0,0]=4 2771 B16R2.98 CCCN1CCOCC1c2ccccc2 269982a_100000765270_100000210303 [0,0,1,0,0,1|2,0,0]=4 2772 B16R2.98 CCCN1CCOCC1c2ccccc2 34a_100000765270_100000210303 [0,0,1,0,0,1|2,0,0]=4 2773 B16R2.98 CCCN1CCSCC1c2ccccc2 2230a_102495339932_100000210303 [0,0,1,0,0,1|2,0,0]=4 2774 B16R2.98 CCCN1CCSCC1c2ccccc2 269982a_102495339932_100000210303 [0,0,1,0,0,1|2,0,0]=4 2775 B16R2.98 CCCN1CCSCC1c2ccccc2 7a_102495339932_100000210303 [0,0,1,0,0,1|2,0,0]=4 2776 B16R2.98 CCNC1CCCCC1c2ccccc2 270004a_100015525214_100000212245 [0,0,1,0,0,1|2,0,0]=4 2777 B16R2.98 CCO[C@@H]1CCCC[C@H]1c2ccccc2 34a_100009815809_100000210202 [0,0,1,0,0,1|2,0,0]=4 2778 B16R2.98 CCO[C@@H]1CCCC[C@H]1c2ccccc2 7a_100009815809_100000210202 [0,0,1,0,0,1|2,0,0]=4 2779 B16R2.23 CCN1CCCC(C1)Cc2ccccc2 2230a_100000752525_100000210202 [0,0,1,0,0,1|2,0,0]=4 2780 B16R2.23 CCN1CCCC(C1)Cc2ccccc2 269982a_100000752525_100000204670 [0,0,1,0,0,1|2,0,0]=4 2781 B16R2.23 CCN1CCCC(C1)Cc2ccccc2 34a_100000752525_100000210202 [0,0,1,0,0,1|2,0,0]=4 2782 B16R2.23 CNC1CCCN(C1)Cc2ccccc2 2230a_100000765084_200000210301 [0,0,1,0,0,1|1,0,0]=3 2783 B16R2.23 COC1CCCN(C1)Cc2ccccc2 2230a_100000695604_100015291786 [0,0,1,0,0,1|2,0,0]=4 2784 B16R2.23 COC1CCCN(C1)Cc2ccccc2 269982a_100000695604_100000211182 [0,0,1,0,0,1|2,0,0]=4 2785 B16R2.23 COC1CCCN(C1)Cc2ccccc2 270004a_100000695604_100015611070 [0,0,1,0,0,1|2,0,0]=4 2786 B16R2.23 COC1CCCN(C1)Cc2ccccc2 34a_100000695604_100015291786 [0,0,1,0,0,1|2,0,0]=4 2787 B16R2.23 [13CH3]NC1CCCN(C1)Cc2ccccc2 2230a_100000765084_200025704644 [0,0,1,0,0,1|1,0,0]=3 2788 B16R2.169 CCC1CCCC1NCc2ccccc2 269862a_100015324214_100000749056 [0,0,1,0,0,1|1,0,0]=3 2789 B16R2.169 CCC1CCCC1NCc2ccccc2 270004a_100015324214_100000749056 [0,0,1,0,0,1|1,0,0]=3 2790 B16R2.169 CCC1CCCC1NCc2ccccn2 270004a_100000210449_100000749056 [0,0,1,0,0,1|2,0,0]=4 2791 B16R2.169 CCC1CCCC1NCc2cccnc2 269862a_100000210453_100000749056 [0,0,1,0,0,1|2,0,0]=4 2792 B16R2.169 CCC1CCCC1NCc2cccnc2 270004a_100000210453_100000749056 [0,0,1,0,0,1|2,0,0]=4 2793 B16R2.169 CCC1CCCC1NCc2ccncc2 269862a_100000210450_100000749056 [0,0,1,0,0,1|2,0,0]=4 2794 B16R2.169 CCC1CCCN1CCc2ccccc2 2230a_100000754278_100000765856 [0,0,1,0,0,1|2,0,0]=4 2795 B16R2.169 CCC1CCCN1CCc2ccccc2 269982a_100000754278_100000765856 [0,0,1,0,0,1|2,0,0]=4 2796 B16R2.169 CCC1CCCN1CCc2ccccc2 34a_100000754278_100000765856 [0,0,1,0,0,1|2,0,0]=4 2797 B16R2.169 CCC1CCCN1CSc2ccccc2 2230a_100000754278_100011218342 [0,0,1,0,0,1|2,0,0]=4 2798 B16R2.169 CCC1CCCN1CSc2ccccc2 269982a_100000754278_100011218342 [0,0,1,0,0,1|2,0,0]=4 2799 B16R2.169 CCN1CCCC1CCc2ccccc2 2230a_100000741814_100000210202 [0,0,1,0,0,1|2,0,0]=4 2800 B16R2.169 CCN1CCCC1CCc2ccccc2 269982a_100000741814_100000204670 [0,0,1,0,0,1|2,0,0]=4 2801 B16R2.169 CCN1CCCC1CCc2ccccc2 34a_100000741814_100000210202 [0,0,1,0,0,1|2,0,0]=4 2802 B16R2.169 CO[C@@H]1CCC[C@H]1NCc2ccccc2 34a_200012001398_200000210301 [0,0,1,0,0,1|1,0,0]=3 2803 B16R2.169 N#C[C@@H]1CCC[C@H]1OCc2ccccc2 34a_100011907464_100015291786 [0,0,1,0,0,1|2,0,0]=4 2804 B16R2.169 N#C[C@@H]1CCC[C@H]1OCc2ccccc2 7a_100011907464_100000211182 [0,0,1,0,0,1|2,0,0]=4 2805 B16R2.169 [13CH3]O[C@@H]1CCC[C@H]1NCc2ccccc2 34a_200012001398_200025704644 [0,0,1,0,0,1|1,0,0]=3 2806 B16R2.172 CCC1CCCCN1Cc2ccccc2 2230a_100000210034_100015291786 [0,0,1,0,0,1|2,0,0]=4 2807 B16R2.172 CCC1CCCCN1Cc2ccccc2 269982a_100000210034_100000211182 [0,0,1,0,0,1|2,0,0]=4 2808 B16R2.172 CCC1CCCCN1Cc2ccccc2 270004a_100000210034_100015611070 [0,0,1,0,0,1|2,0,0]=4 2809 B16R2.172 CCC1CCCCN1Cc2ccccc2 34a_100000210034_100015291786 [0,0,1,0,0,1|2,0,0]=4 2810 B16R2.172 CCN1CCCCC1Cc2ccccc2 2230a_100000748602_100000210202 [0,0,1,0,0,1|2,0,0]=4 2811 B16R2.172 CCN1CCCCC1Cc2ccccc2 269982a_100000748602_100000204670 [0,0,1,0,0,1|2,0,0]=4 2812 B16R2.172 CCN1CCCCC1Cc2ccccc2 34a_100000748602_100000210202 [0,0,1,0,0,1|2,0,0]=4 2813 B16R2.172 CCN1CCOC[C@@H]1Cc2ccccc2 2230a_100009820136_100000210202 [0,0,1,0,0,1|2,0,0]=4 2814 B16R2.172 CCN1CCOC[C@@H]1Cc2ccccc2 269982a_100009820136_100000204670 [0,0,1,0,0,1|2,0,0]=4 2815 B16R2.172 CCN1CCOC[C@@H]1Cc2ccccc2 34a_100009820136_100000210202 [0,0,1,0,0,1|2,0,0]=4 2816 B16R2.172 CC[C@H]1COCCN1Cc2ccccc2 2230a_100016988097_100015291786 [0,0,1,0,0,1|2,0,0]=4 2817 B16R2.172 CC[C@H]1COCCN1Cc2ccccc2 269982a_100016988097_100000211182 [0,0,1,0,0,1|2,0,0]=4 2818 B16R2.172 CC[C@H]1COCCN1Cc2ccccc2 270004a_100016988097_100015611070 [0,0,1,0,0,1|2,0,0]=4 2819 B16R2.172 CC[C@H]1COCCN1Cc2ccccc2 34a_100016988097_100015291786 [0,0,1,0,0,1|2,0,0]=4 2820 B16R2.172 CNC1CCCCC1Cc2ccccc2 269862a_106832991636_100011217200 [0,0,1,0,0,1|0,0,0]=2 2821 B16R2.172 CNC1CCCCC1Cc2ccccc2 270004a_106832991635_100011217200 [0,0,1,0,0,1|0,0,0]=2 2822 B16R2.101 CCC(Cc1ccccc1)N2CCCC2 270004a_100000188435_100000212045 [0,0,1,0,0,1|2,0,0]=4 2823 B16R2.101 CCN(Cc1ccccc1)C2CCCC2 2230a_100000186914_100000179811 [0,0,1,0,0,1|2,0,0]=4 2824 B16R2.101 CCN(Cc1ccccc1)C2CCCC2 269982a_100000186914_100000179811 [0,0,1,0,0,1|2,0,0]=4 2825 B16R2.101 CCN(Cc1ccccc1)C2CCCC2 270004a_100000186914_100000210133 [0,0,1,0,0,1|2,0,0]=4 2826 B16R2.187 CCN(c1ccccc1)C2CCCCC2 2230a_100000181333_100000210202 [0,0,1,0,0,1|2,0,0]=4 2827 B16R2.187 CCN(c1ccccc1)C2CCCCC2 269982a_100000181333_100000204670 [0,0,1,0,0,1|2,0,0]=4 2828 B16R2.187 CCN(c1ccccc1)C2CCCCC2 269982a_100000210013_100000210327 [0,0,1,0,0,1|2,0,0]=4 2829 B16R2.187 CCN(c1ccccc1)C2CCCCC2 34a_100000181333_100000210202 [0,0,1,0,0,1|2,0,0]=4 2830 B16R2.187 CCN(c1ccccc1)C2CCCCC2 34a_100000210013_100000210327 [0,0,1,0,0,1|2,0,0]=4 2831 B16R2.187 CCN(c1ccccc1)C2CCCCC2 7a_100000181333_100000210202 [0,0,1,0,0,1|2,0,0]=4 2832 B16R2.187 CCN(c1ccccc1)C2CCCOC2 269982a_100000210013_100000693364 [0,0,1,0,0,1|2,0,0]=4 2833 B16R2.187 CCN(c1ccccc1)C2CCCOC2 34a_100000210013_100000693364 [0,0,1,0,0,1|2,0,0]=4 2834 B16R2.187 CCN(c1ccccc1)C2CCOCC2 269982a_100000210013_100011324220 [0,0,1,0,0,1|2,0,0]=4 2835 B16R2.187 CCN(c1ccccc1)C2CCSCC2 269982a_100000210013_100000069128 [0,0,1,0,0,1|2,0,0]=4 2836 B16R2.187 CCN(c1ccccc1)C2CCSCC2 34a_100000210013_100000069128 [0,0,1,0,0,1|2,0,0]=4 2837 B16R2.187 CNC(c1ccccc1)C2CCCCC2 2230a_100000739561_200000210301 [0,0,1,0,0,1|2,0,0]=4 2838 B16R2.187 CNC(c1ccccc1)C2CCCCC2 269862a_106832991636_100000211043 [0,0,1,0,0,1|2,0,0]=4 2839 B16R2.187 CNC(c1ccccc1)C2CCCCC2 34a_100000739561_200000210301 [0,0,1,0,0,1|2,0,0]=4 2840 B16R2.187 CNC(c1ccccc1)C2CCCNC2 269862a_106832991636_100015185631 [0,0,1,0,0,1|2,0,0]=4 2841 B16R2.187 CNC(c1ccccc1)C2CCNCC2 269862a_106832991636_100000736635 [0,0,1,0,0,1|2,0,0]=4 2842 B16R2.187 CNC(c1ccccc1)C2CCOCC2 269862a_106832991636_200000755960 [0,0,1,0,0,1|2,0,0]=4 2843 B16R2.187 COC(c1ccccc1)C2CCCCC2 34a_100011220086_200000210301 [0,0,1,0,0,1|2,0,0]=4 2844 B16R2.187 COC(c1ccccc1)C2CCCCC2 7a_100011220086_200000210301 [0,0,1,0,0,1|2,0,0]=4 2845 B16R2.187 COC(c1ccccc1)C2CCCCN2 34a_100000748754_200000210301 [0,0,1,0,0,1|2,0,0]=4 2846 B16R2.187 COC(c1ccccc1)C2CCNCC2 34a_100000735454_200000210301 [0,0,1,0,0,1|2,0,0]=4 2847 B16R2.187 CO[C@@H](c1ccccc1)C2CCOCC2 34a_200011056286_200000210301 [0,0,1,0,0,1|2,0,0]=4 2848 B16R2.187 CO[C@@H](c1ccccc1)C2CCOCC2 7a_200011056286_200000210301 [0,0,1,0,0,1|2,0,0]=4 2849 B16R2.187 FCN(c1ccccc1)C2CCCCC2 269982a_100000181333_100015361967 [0,0,1,0,0,1|2,0,0]=4 2850 B16R2.187 FCN(c1ccccc1)C2CCCCC2 34a_100000181333_100015361967 [0,0,1,0,0,1|2,0,0]=4 2851 B16R2.187 FCN(c1ccccc1)C2CCCCC2 7a_100000181333_100015361967 [0,0,1,0,0,1|2,0,0]=4 2852 B16R2.187 [13CH3]NC(c1ccccc1)C2CCCCC2 2230a_100000739561_200025704644 [0,0,1,0,0,1|2,0,0]=4 2853 B16R2.187 [13CH3]NC(c1ccccc1)C2CCCCC2 34a_100000739561_200025704644 [0,0,1,0,0,1|2,0,0]=4 2854 B16R2.187 [13CH3]OC(c1ccccc1)C2CCCCC2 34a_100011220086_200025704644 [0,0,1,0,0,1|2,0,0]=4 2855 B16R2.187 [13CH3]OC(c1ccccc1)C2CCCCC2 7a_100011220086_200025704644 [0,0,1,0,0,1|2,0,0]=4 2856 B16R2.187 [13CH3]OC(c1ccccc1)C2CCCCN2 34a_100000748754_200025704644 [0,0,1,0,0,1|2,0,0]=4 2857 B16R2.187 [13CH3]OC(c1ccccc1)C2CCNCC2 34a_100000735454_200025704644 [0,0,1,0,0,1|2,0,0]=4 2858 B16R2.187 [13CH3]O[C@@H](c1ccccc1)C2CCOCC2 34a_200011056286_200025704644 [0,0,1,0,0,1|2,0,0]=4 2859 B16R2.187 [13CH3]O[C@@H](c1ccccc1)C2CCOCC2 7a_200011056286_200025704644 [0,0,1,0,0,1|2,0,0]=4 2860 B16R2.685 BrCC(OC1CCCC1)c2ccccc2 7a_100000185958_100000179811 [0,0,1,0,0,1|1,0,0]=3 2861 B16R2.685 BrCC(OC1CCOC1)c2ccccc2 7a_100000185958_100000731011 [0,0,1,0,0,1|2,0,0]=4 2862 B16R2.685 C#CC(OC1CCCC1)c2ccccc2 34a_100011219616_100000179811 [0,0,1,0,0,1|1,0,1]=4 2863 B16R2.685 C#CC(OC1CCCC1)c2ccccc2 7a_100011219616_100000179811 [0,0,1,0,0,1|1,0,1]=4 2864 B16R2.685 C=CC(NC1CCCC1)c2ccccc2 2230a_100000211070_200000085779 [0,0,1,0,0,1|1,0,1]=4 2865 B16R2.685 C=CC(OC1CCCC1)c2ccccc2 34a_100011215659_100000179811 [0,0,1,0,0,1|1,0,1]=4 2866 B16R2.685 C=CC(OC1CCCC1)c2ccccc2 7a_100011215659_100000179811 [0,0,1,0,0,1|1,0,1]=4 2867 B16R2.685 C=CC(SC1CCCC1)c2ccccc2 62a_100011217020_200000085779 [0,0,1,0,0,1|1,0,1]=4 2868 B16R2.685 C=CC(SC1CCCC1)c2ccccc2 62a_200000085779_100000179811 [0,0,1,0,0,1|1,0,1]=4 2869 B16R2.685 CCC(CN1CCCC1)c2ccccc2 270004a_100000188435_100000753018 [0,0,1,0,0,1|2,0,0]=4 2870 B16R2.685 CCC(NC1CCCC1)c2ccccc2 2230a_100000737752_100000179811 [0,0,1,0,0,1|1,0,0]=3 2871 B16R2.685 CCC(NC1CCCC1)c2ccccc2 269862a_100000211070_100000210124 [0,0,1,0,0,1|1,0,0]=3 2872 B16R2.685 CCC(NC1CCCC1)c2ccccc2 270004a_100000737752_100000210133 [0,0,1,0,0,1|1,0,0]=3 2873 B16R2.685 CCC(NC1CCCC1)c2ccccn2 2230a_100015186561_100000179811 [0,0,1,0,0,1|2,0,0]=4 2874 B16R2.685 CCC(NC1CCCC1)c2ccccn2 269862a_100000211070_100000748178 [0,0,1,0,0,1|2,0,0]=4 2875 B16R2.685 CCC(NC1CCCC1)c2ccccn2 270004a_100015186561_100000210133 [0,0,1,0,0,1|2,0,0]=4 2876 B16R2.685 CCC(NC1CCCC1)c2cccnc2 2230a_100000246009_100000179811 [0,0,1,0,0,1|2,0,0]=4 2877 B16R2.685 CCC(NC1CCCC1)c2cccnc2 269862a_100000211070_100011218761 [0,0,1,0,0,1|2,0,0]=4 2878 B16R2.685 CCC(NC1CCCC1)c2cccnc2 270004a_100000246009_100000210133 [0,0,1,0,0,1|2,0,0]=4 2879 B16R2.685 CCC(NC1CCCC1)c2ccncc2 269862a_100000211070_100011216016 [0,0,1,0,0,1|2,0,0]=4 2880 B16R2.685 CCC(NC1CCCC1)c2ccncc2 270004a_100000246010_100000210133 [0,0,1,0,0,1|2,0,0]=4 2881 B16R2.685 CCC(NC1CCOC1)c2ccccc2 2230a_100000737752_100000731011 [0,0,1,0,0,1|2,0,0]=4 2882 B16R2.685 CCC(NC1CCOC1)c2ccccc2 270004a_100000737752_100000752484 [0,0,1,0,0,1|2,0,0]=4 2883 B16R2.685 CCC(NC1CCSC1)c2ccccc2 270004a_100000737752_100000212027 [0,0,1,0,0,1|2,0,0]=4 2884 B16R2.685 CCC(N[C@@H]1CCOC1)c2ccccc2 269862a_200015188469_100000210124 [0,0,1,0,0,1|2,0,0]=4 2885 B16R2.685 CCC(N[C@H]1CCOC1)c2ccccc2 269862a_100015188467_100000210124 [0,0,1,0,0,1|2,0,0]=4 2886 B16R2.685 CCC(OC1CCCC1)c2ccccc2 34a_100000698172_100000179811 [0,0,1,0,0,1|1,0,0]=3 2887 B16R2.685 CCC(OC1CCCC1)c2ccccc2 7a_100000698172_100000179811 [0,0,1,0,0,1|1,0,0]=3 2888 B16R2.685 CCC(OC1CCOC1)c2ccccc2 34a_100000698172_100000690089 [0,0,1,0,0,1|2,0,0]=4 2889 B16R2.685 CCC(OC1CCOC1)c2ccccc2 7a_100000698172_100000731011 [0,0,1,0,0,1|2,0,0]=4 2890 B16R2.685 CCN(CC1CCCC1)c2ccccc2 2230a_100000210013_100000740388 [0,0,1,0,0,1|2,0,0]=4 2891 B16R2.685 CCN(CC1CCCC1)c2ccccc2 269982a_100000210013_100000740388 [0,0,1,0,0,1|2,0,0]=4 2892 B16R2.685 CCN(CC1CCCC1)c2ccccc2 34a_100000210013_100000740388 [0,0,1,0,0,1|2,0,0]=4 2893 B16R2.685 ClC[C@@H](OC1CCCC1)c2ccccc2 34a_100011933945_100000179811 [0,0,1,0,0,1|1,0,0]=3 2894 B16R2.685 ClC[C@@H](OC1CCCC1)c2ccccc2 7a_100011933945_100000179811 [0,0,1,0,0,1|1,0,0]=3 2895 B16R2.685 ClC[C@@H](OC1CCOC1)c2ccccc2 34a_100011933945_100000690089 [0,0,1,0,0,1|2,0,0]=4 2896 B16R2.685 ClC[C@@H](OC1CCOC1)c2ccccc2 7a_100011933945_100000731011 [0,0,1,0,0,1|2,0,0]=4 2897 B16R2.685 N#CC(OC1CCCC1)c2ccccc2 7a_100011217353_100000179811 [0,0,1,0,0,1|0,0,2]=4 2898 B16R2.685 NCC(OC1CCCC1)c2ccccc2 34a_100000210709_100000179811 [0,0,1,0,0,1|0,0,0]=2 2899 B16R2.685 NCC(OC1CCOC1)c2ccccc2 34a_100000210709_100000690089 [0,0,1,0,0,1|1,0,0]=3 2900 B16R2.685 OCC(NC1CCCC1)c2ccccn2 2230a_100015196888_100000179811 [0,0,1,0,0,1|2,0,0]=4 2901 B16R2.685 OCC(NC1CCCC1)c2ccccn2 270004a_100015196888_100000210133 [0,0,1,0,0,1|2,0,0]=4 2902 B16R2.685 OC[C@@H](NC1CCCC1)c2ccccc2 2230a_100000751927_100000179811 [0,0,1,0,0,1|1,0,0]=3 2903 B16R2.685 OC[C@@H](NC1CCCC1)c2ccccc2 270004a_100000751927_100000210133 [0,0,1,0,0,1|1,0,0]=3 2904 B16R2.685 OC[C@@H](NC1CCCC1)c2ccccc2 34a_100000751927_100000179811 [0,0,1,0,0,1|1,0,0]=3 2905 B16R2.685 OC[C@@H](NC1CCCC1)c2ccncc2 2230a_100138412524_100000179811 [0,0,1,0,0,1|2,0,0]=4 2906 B16R2.685 OC[C@@H](NC1CCCC1)c2ccncc2 270004a_100138412524_100000210133 [0,0,1,0,0,1|2,0,0]=4 2907 B16R2.685 OC[C@@H](NC1CCOC1)c2ccccc2 2230a_100000751927_100000731011 [0,0,1,0,0,1|2,0,0]=4 2908 B16R2.685 OC[C@@H](NC1CCOC1)c2ccccc2 270004a_100000751927_100000752484 [0,0,1,0,0,1|2,0,0]=4 2909 B16R2.685 OC[C@@H](NC1CCOC1)c2ccccc2 34a_100000751927_100000690089 [0,0,1,0,0,1|2,0,0]=4 2910 B16R2.685 OC[C@@H](NC1CCSC1)c2ccccc2 270004a_100000751927_100000212027 [0,0,1,0,0,1|2,0,0]=4 2911 B16R2.236 CC(c1ccccc1)N2CCCC(C2)F 2230a_100000697950_100000230085 [0,0,1,0,0,1|2,0,0]=4 2912 B16R2.236 CC(c1ccccc1)N2CCCC(C2)F 269982a_100000697950_100000230085 [0,0,1,0,0,1|2,0,0]=4 2913 B16R2.236 CC(c1ccccc1)N2CCCC(C2)F 34a_100000697950_100000211855 [0,0,1,0,0,1|2,0,0]=4 2914 B16R2.236 CC(c1ccccc1)N2CCCC(C2)O 2230a_100000211013_100000230085 [0,0,1,0,0,1|2,0,0]=4 2915 B16R2.236 CC(c1ccccc1)N2CCCC(C2)O 269982a_100000211013_100000230085 [0,0,1,0,0,1|2,0,0]=4 2916 B16R2.236 CC(c1ccccc1)N2CCC[C@@H](C2)C 2230a_100000717927_100000230085 [0,0,1,0,0,1|2,0,0]=4 2917 B16R2.236 CC(c1ccccc1)N2CCC[C@@H](C2)C 269982a_100000717927_100000230085 [0,0,1,0,0,1|2,0,0]=4 2918 B16R2.236 CC(c1ccccc1)N2CCC[C@@H](C2)C 34a_100000717927_100000211855 [0,0,1,0,0,1|2,0,0]=4 2919 B16R2.3005 CC(Cc1ccccc1)N2CCC[C@@H]2C 269982a_100020605311_200011218536 [0,0,1,0,0,1|2,0,0]=4 2920 B16R2.3005 CC(Cc1ccccc1)N2CCC[C@H]2C 269982a_100015189458_200011218536 [0,0,1,0,0,1|2,0,0]=4 2921 B16R2.3005 CC(Cc1ccccc1)N2CCC[C@H]2C 34a_100015189458_200011218536 [0,0,1,0,0,1|2,0,0]=4 2922 B16R2.3005 CN(Cc1ccccc1)[C@@H]2CCC[C@H]2O 2230a_200012001398_200000210301 [0,0,1,0,0,1|2,0,0]=4 2923 B16R2.3005 CN(Cc1ccccc1)[C@@H]2CCC[C@H]2O 269982a_100000186898_200016002552 [0,0,1,0,0,1|2,0,0]=4 2924 B16R2.3005 CN(Cc1ccccc1)[C@@H]2CCC[C@H]2O 269982a_200012001398_200000210301 [0,0,1,0,0,1|2,0,0]=4 2925 B16R2.3005 [13CH3]N(Cc1ccccc1)[C@@H]2CCC[C@H]2O 2230a_200012001398_200025704644 [0,0,1,0,0,1|2,0,0]=4 2926 B16R2.3005 [13CH3]N(Cc1ccccc1)[C@@H]2CCC[C@H]2O 269982a_200012001398_200025704644 [0,0,1,0,0,1|2,0,0]=4 2927 B16R2.3014 CC(CN1CCC[C@@H]1C)c2ccccc2 2230a_100020605311_100000756946 [0,0,1,0,0,1|2,0,0]=4 2928 B16R2.3014 CC(CN1CCC[C@@H]1C)c2ccccc2 269982a_100020605311_100000756946 [0,0,1,0,0,1|2,0,0]=4 2929 B16R2.3014 CC(CN1CCC[C@@H]1C)c2ccccc2 270004a_100020605311_100000212034 [0,0,1,0,0,1|2,0,0]=4 2930 B16R2.3014 CC(CN1CCC[C@H]1C)c2ccccc2 2230a_100015189458_100000756946 [0,0,1,0,0,1|2,0,0]=4 2931 B16R2.3014 CC(CN1CCC[C@H]1C)c2ccccc2 269982a_100015189458_100000756946 [0,0,1,0,0,1|2,0,0]=4 2932 B16R2.3014 CC(CN1CCC[C@H]1C)c2ccccc2 270004a_100015189458_100000212034 [0,0,1,0,0,1|2,0,0]=4 2933 B16R2.3014 CC(CN1CCC[C@H]1C)c2ccccc2 34a_100015189458_100000756946 [0,0,1,0,0,1|2,0,0]=4 2934 B16R2.3014 CC(NC1CCCC1C)c2ccccn2 269862a_100000181244_100000752053 [0,0,1,0,0,1|2,0,0]=4 2935 B16R2.3014 CC(NC1CCCC1C)c2cccnc2 269862a_100000195435_100000752053 [0,0,1,0,0,1|2,0,0]=4 2936 B16R2.3014 CC(NC1CCCC1C)c2ccncc2 269862a_100000181269_100000752053 [0,0,1,0,0,1|2,0,0]=4 2937 B16R2.3014 CC(N[C@H]1CCC[C@@H]1O)c2ccccc2 269862a_100000748460_100000185851 [0,0,1,0,0,1|1,0,0]=3 2938 B16R2.3014 CC(N[C@H]1CCC[C@@H]1O)c2ccccn2 269862a_100000748460_100000210467 [0,0,1,0,0,1|2,0,0]=4 2939 B16R2.3014 CC(N[C@H]1CCC[C@@H]1O)c2cccnc2 269862a_100000748460_100000210468 [0,0,1,0,0,1|2,0,0]=4 2940 B16R2.3014 CC(N[C@H]1CCC[C@@H]1O)c2ccncc2 269862a_100000748460_100000185792 [0,0,1,0,0,1|2,0,0]=4 2941 B16R2.3014 CC(N[C@H]1COC[C@@H]1O)c2ccccc2 2230a_100015191717_100000230085 [0,0,1,0,0,1|2,0,0]=4 2942 B16R2.3014 CC(N[C@H]1COC[C@@H]1O)c2ccccc2 269862a_100015191717_100000185851 [0,0,1,0,0,1|2,0,0]=4 2943 B16R2.3014 CC(OC1CCCC1=O)c2ccccc2 34a_200000719330_100000211855 [0,0,1,0,0,1|1,0,1]=4 2944 B16R2.3014 CC(OC1CCCC1C)c2ccccc2 34a_100011216460_100000211855 [0,0,1,0,0,1|1,0,0]=3 2945 B16R2.3014 CC(OC1CCCC1C)c2ccccc2 7a_100011216460_100000230085 [0,0,1,0,0,1|1,0,0]=3 2946 B16R2.3014 CC(O[C@@H]1CCC[C@H]1Cl)c2ccccc2 34a_200016002552_100000211855 [0,0,1,0,0,1|1,0,0]=3 2947 B16R2.3014 CC(O[C@H]1CCC[C@@H]1N)c2ccccc2 34a_100000748460_100000211855 [0,0,1,0,0,1|0,0,0]=2 2948 B16R2.3014 CC(O[C@H]1CNC[C@H]1C)c2ccccc2 34a_200015306588_100000211855 [0,0,1,0,0,1|2,0,0]=4 2949 B16R2.3014 CC(O[C@H]1COC[C@@H]1N)c2ccccc2 34a_100015191717_100000211855 [0,0,1,0,0,1|1,0,0]=3 2950 B16R2.3014 CC(SC1CCCC1=O)c2ccccc2 62a_100000211823_100000230085 [0,0,1,0,0,1|1,0,1]=4 2951 B16R2.3014 CC(SC1CCCC1=O)c2ccccc2 62a_100000230085_100000211823 [0,0,1,0,0,1|1,0,1]=4 2952 B16R2.3014 CC(SC1COCC1O)c2ccccc2 62a_100000230085_200000725654 [0,0,1,0,0,1|2,0,0]=4 2953 B16R2.3014 CC(SC1COCC1O)c2ccccc2 62a_200000725654_100000230085 [0,0,1,0,0,1|2,0,0]=4 2954 B16R2.3014 CC(S[C@@H]1CCC[C@H]1O)c2ccccc2 62a_100000230085_200016002552 [0,0,1,0,0,1|1,0,0]=3 2955 B16R2.3014 CC(S[C@@H]1CCC[C@H]1O)c2ccccc2 62a_200016002552_100000230085 [0,0,1,0,0,1|1,0,0]=3 2956 B16R2.3014 CC1CCCC1N[C@H](C)c2ccccc2 269862a_100000751104_100000752053 [0,0,1,0,0,1|1,0,0]=3 2957 B16R2.3014 CC1OCCC1N[C@H](C)c2ccccc2 270004a_100000751104_100000691750 [0,0,1,0,0,1|2,0,0]=4 2958 B16R2.3014 C[C@@H](NC1CCCC1=O)c2ccccc2 2230a_100000751104_100000211823 [0,0,1,0,0,1|1,0,1]=4 2959 B16R2.3014 C[C@@H](OC1CCCC1=O)c2ccccc2 34a_100000761318_100000709159 [0,0,1,0,0,1|1,0,1]=4 2960 B16R2.3014 C[C@@H](OC1CCCC1=O)c2ccccc2 7a_100000761318_100000211823 [0,0,1,0,0,1|1,0,1]=4 2961 B16R2.3014 C[C@@H](OC1COCC1O)c2ccccc2 34a_100000761318_200000725654 [0,0,1,0,0,1|2,0,0]=4 2962 B16R2.3014 C[C@@H](OC1COCC1O)c2ccccc2 7a_100000761318_200000725654 [0,0,1,0,0,1|2,0,0]=4 2963 B16R2.3896 CC(c1ccccc1)N2CCOC[C@@H]2C 2230a_100009815349_100000230085 [0,0,1,0,0,1|2,0,0]=4 2964 B16R2.3896 CC(c1ccccc1)N2CCOC[C@@H]2C 269982a_100009815349_100000230085 [0,0,1,0,0,1|2,0,0]=4 2965 B16R2.3896 CC(c1ccccc1)N2CCOC[C@@H]2C 34a_100009815349_100000211855 [0,0,1,0,0,1|2,0,0]=4 2966 B16R2.3896 CC1CCCCN1C(C)c2ccccc2 2230a_100000211376_100000230085 [0,0,1,0,0,1|2,0,0]=4 2967 B16R2.3896 CC1CCCCN1C(C)c2ccccc2 269982a_100000211376_100000230085 [0,0,1,0,0,1|2,0,0]=4 2968 B16R2.3896 CC1CCCCN1C(C)c2ccccc2 34a_100000211376_100000211855 [0,0,1,0,0,1|2,0,0]=4 2969 B16R2.3896 CN(c1ccccc1)C2CCCCC2F 269982a_100000210012_100015423560 [0,0,1,0,0,1|2,0,0]=4 2970 B16R2.3896 CN(c1ccccc1)C2CCCCC2F 34a_100000210012_100015423560 [0,0,1,0,0,1|2,0,0]=4 2971 B16R2.3896 CN(c1ccccc1)C2CCCCC2O 269982a_100000210012_100000038908 [0,0,1,0,0,1|2,0,0]=4 2972 B16R2.3896 CN(c1ccccc1)C2CCCCC2O 34a_100000210012_100000038908 [0,0,1,0,0,1|2,0,0]=4 2973 B16R2.2211 c1ccc(cc1)CN2CCCCCCC2 2230a_100000211400_100015291786 [0,0,1,0,0,1|2,0,0]=4 2974 B16R2.2211 c1ccc(cc1)CN2CCCCCCC2 269982a_100000211400_100000211182 [0,0,1,0,0,1|2,0,0]=4 2975 B16R2.2211 c1ccc(cc1)CN2CCCCCCC2 270004a_100000211400_100015611070 [0,0,1,0,0,1|2,0,0]=4 2976 B16R2.2211 c1ccc(cc1)CN2CCCCCCC2 34a_100000211400_100015291786 [0,0,1,0,0,1|2,0,0]=4 2977 B16R2.2256 C(=NNC1CCCCC1)c2ccccc2 4a_100000709804_100015611070 [0,0,1,0,0,1|1,0,1]=4 2978 B16R2.2256 C(=NNC1CCOCC1)c2ccccc2 4a_100000687383_100015611070 [0,0,1,0,0,1|1,0,1]=4 2979 B16R2.2256 C1=CC(CCC1)NCCc2ccccc2 2230a_100000106460_100000751183 [0,0,1,0,0,1|0,0,1]=3 2980 B16R2.2256 C1=CC(CCC1)NCCc2cccnc2 2230a_100000736294_100000751183 [0,0,1,0,0,1|1,0,1]=4 2981 B16R2.2256 C1=CC(CCC1)OCCc2ccccc2 34a_100011215024_100000765856 [0,0,1,0,0,1|1,0,1]=4 2982 B16R2.2256 C1=CC(CCC1)OCCc2ccccc2 7a_100000210268_100000751183 [0,0,1,0,0,1|1,0,1]=4 2983 B16R2.2256 C1=CC(CCC1)SCCc2ccccc2 62a_100000751183_100011218657 [0,0,1,0,0,1|1,0,1]=4 2984 B16R2.2256 C1=CC(CCC1)SCCc2ccccc2 62a_100000765856_100000751183 [0,0,1,0,0,1|1,0,1]=4 2985 B16R2.2256 C1=CCC(CC1)OCCc2ccccc2 34a_100000073881_100000765856 [0,0,1,0,0,1|1,0,1]=4 2986 B16R2.2256 c1cc(ccn1)CCNC2CCCCC2 2230a_100000182618_100000723409 [0,0,1,0,0,1|1,0,0]=3 2987 B16R2.2256 c1cc(ccn1)CCNC2CCCCC2 270004a_100000742849_100000210434 [0,0,1,0,0,1|1,0,0]=3 2988 B16R2.2256 c1cc(ccn1)CCNC2CCCOC2 2230a_100000719290_100000723409 [0,0,1,0,0,1|1,0,0]=3 2989 B16R2.2256 c1cc(ccn1)CCNC2CCCOC2 270004a_100000742849_100000753404 [0,0,1,0,0,1|1,0,0]=3 2990 B16R2.2256 c1cc(ccn1)CCNC2CCCSC2 270004a_100000742849_100000057913 [0,0,1,0,0,1|1,0,0]=3 2991 B16R2.2256 c1cc(ccn1)CCNC2CCNCC2 270004a_100000742849_100015192401 [0,0,1,0,0,1|1,0,0]=3 2992 B16R2.2256 c1cc(ccn1)CCNC2CCOCC2 2230a_100000741149_100000723409 [0,0,1,0,0,1|1,0,0]=3 2993 B16R2.2256 c1cc(ccn1)CCNC2CCOCC2 270004a_100000742849_100011217826 [0,0,1,0,0,1|1,0,0]=3 2994 B16R2.2256 c1cc(ccn1)CCNC2CCSCC2 2230a_100000748639_100000723409 [0,0,1,0,0,1|1,0,0]=3 2995 B16R2.2256 c1cc(ccn1)CCNC2CCSCC2 270004a_100000742849_100000203788 [0,0,1,0,0,1|1,0,0]=3 2996 B16R2.2256 c1cc(ccn1)CCOC2CCCCC2 34a_100011216225_100000210327 [0,0,1,0,0,1|2,0,0]=4 2997 B16R2.2256 c1cc(ccn1)CCOC2CCCCC2 7a_100000210231_100000723409 [0,0,1,0,0,1|2,0,0]=4 2998 B16R2.2256 c1cc(ccn1)CCOC2CCCOC2 34a_100011216225_100000693364 [0,0,1,0,0,1|2,0,0]=4 2999 B16R2.2256 c1cc(ccn1)CCOC2CCCSC2 7a_100015962668_100000723409 [0,0,1,0,0,1|2,0,0]=4 3000 B16R2.2256 c1cc(ccn1)CCOC2CCSCC2 34a_100011216225_100000069128 [0,0,1,0,0,1|2,0,0]=4 3001 B16R2.2256 c1cc(ccn1)CCOC2CCSCC2 7a_100000731022_100000723409 [0,0,1,0,0,1|2,0,0]=4 3002 B16R2.2256 c1cc(ccn1)CCSC2CCCCC2 62a_100000210327_100000723409 [0,0,1,0,0,1|2,0,0]=4 3003 B16R2.2256 c1cc(ccn1)CCSC2CCCCC2 62a_100000723409_100000210327 [0,0,1,0,0,1|2,0,0]=4 3004 B16R2.2256 c1cc(ccn1)CCSC2CCCOC2 62a_100000723409_100000693364 [0,0,1,0,0,1|2,0,0]=4 3005 B16R2.2256 c1cc(ccn1)CCSC2CCOCC2 62a_100000723409_100011324220 [0,0,1,0,0,1|2,0,0]=4 3006 B16R2.2256 c1cc(ccn1)CCSC2CCSCC2 62a_100000723409_100000069128 [0,0,1,0,0,1|2,0,0]=4 3007 B16R2.2256 c1ccc(cc1)CCCN2CCCOC2 2230a_100000131196_100000211621 [0,0,1,0,0,1|2,0,0]=4 3008 B16R2.2256 c1ccc(cc1)CCCN2CCCOC2 269982a_100000131196_100000211621 [0,0,1,0,0,1|2,0,0]=4 3009 B16R2.2256 c1ccc(cc1)CCCN2CCCOC2 34a_100000131196_100000211621 [0,0,1,0,0,1|2,0,0]=4 3010 B16R2.2256 c1ccc(cc1)CCCN2CCOCC2 2230a_100015191051_100000211621 [0,0,1,0,0,1|2,0,0]=4 3011 B16R2.2256 c1ccc(cc1)CCCN2CCOCC2 269982a_100015191051_100000211621 [0,0,1,0,0,1|2,0,0]=4 3012 B16R2.2256 c1ccc(cc1)CCCN2CCOCC2 34a_100015191051_100000211621 [0,0,1,0,0,1|2,0,0]=4 3013 B16R2.2256 c1ccc(cc1)CCCN2CCSCC2 2230a_100000737611_100000211621 [0,0,1,0,0,1|2,0,0]=4 3014 B16R2.2256 c1ccc(cc1)CCCN2CCSCC2 269982a_100000737611_100000211621 [0,0,1,0,0,1|2,0,0]=4 3015 B16R2.2256 c1ccc(cc1)CCNC2CCCCC2 2230a_100000182618_100000765856 [0,0,1,0,0,1|0,0,0]=2 3016 B16R2.2256 c1ccc(cc1)CCNC2CCCCC2 270004a_100000106460_100000210434 [0,0,1,0,0,1|0,0,0]=2 3017 B16R2.2256 c1ccc(cc1)CCNC2CCCCC2 34a_100000106460_100000210327 [0,0,1,0,0,1|0,0,0]=2 3018 B16R2.2256 c1ccc(cc1)CCNC2CCCCC2 34a_100000182618_100000765856 [0,0,1,0,0,1|0,0,0]=2 3019 B16R2.2256 c1ccc(cc1)CCNC2CCCOC2 2230a_100000719290_100000765856 [0,0,1,0,0,1|0,0,0]=2 3020 B16R2.2256 c1ccc(cc1)CCNC2CCCOC2 270004a_100000106460_100000753404 [0,0,1,0,0,1|0,0,0]=2 3021 B16R2.2256 c1ccc(cc1)CCNC2CCCOC2 34a_100000106460_100000693364 [0,0,1,0,0,1|0,0,0]=2 3022 B16R2.2256 c1ccc(cc1)CCNC2CCCOC2 34a_100000719290_100000765856 [0,0,1,0,0,1|0,0,0]=2 3023 B16R2.2256 c1ccc(cc1)CCNC2CCCSC2 270004a_100000106460_100000057913 [0,0,1,0,0,1|0,0,0]=2 3024 B16R2.2256 c1ccc(cc1)CCNC2CCNCC2 270004a_100000106460_100015192401 [0,0,1,0,0,1|0,0,0]=2 3025 B16R2.2256 c1ccc(cc1)CCNC2CCOCC2 2230a_100000741149_100000765856 [0,0,1,0,0,1|0,0,0]=2 3026 B16R2.2256 c1ccc(cc1)CCNC2CCOCC2 270004a_100000106460_100011217826 [0,0,1,0,0,1|0,0,0]=2 3027 B16R2.2256 c1ccc(cc1)CCNC2CCOCC2 34a_100000741149_100000765856 [0,0,1,0,0,1|0,0,0]=2 3028 B16R2.2256 c1ccc(cc1)CCNC2CCSCC2 2230a_100000748639_100000765856 [0,0,1,0,0,1|0,0,0]=2 3029 B16R2.2256 c1ccc(cc1)CCNC2CCSCC2 270004a_100000106460_100000203788 [0,0,1,0,0,1|0,0,0]=2 3030 B16R2.2256 c1ccc(cc1)CCNC2CCSCC2 34a_100000106460_100000069128 [0,0,1,0,0,1|0,0,0]=2 3031 B16R2.2256 c1ccc(cc1)CCNC2CCSCC2 34a_100000748639_100000765856 [0,0,1,0,0,1|0,0,0]=2 3032 B16R2.2256 c1ccc(cc1)CCOC2CCCCC2 34a_100000210231_100000765856 [0,0,1,0,0,1|1,0,0]=3 3033 B16R2.2256 c1ccc(cc1)CCOC2CCCCC2 34a_100000210268_100000210327 [0,0,1,0,0,1|1,0,0]=3 3034 B16R2.2256 c1ccc(cc1)CCOC2CCCCC2 7a_100000210231_100000765856 [0,0,1,0,0,1|1,0,0]=3 3035 B16R2.2256 c1ccc(cc1)CCOC2CCCCC2 7a_100000210268_100000210327 [0,0,1,0,0,1|1,0,0]=3 3036 B16R2.2256 c1ccc(cc1)CCOC2CCCCO2 34a_100000033831_100000765856 [0,0,1,0,0,1|1,0,0]=3 3037 B16R2.2256 c1ccc(cc1)CCOC2CCCOC2 34a_100000210268_100000693364 [0,0,1,0,0,1|1,0,0]=3 3038 B16R2.2256 c1ccc(cc1)CCOC2CCCOC2 34a_100000754041_100000765856 [0,0,1,0,0,1|1,0,0]=3 3039 B16R2.2256 c1ccc(cc1)CCOC2CCCOC2 7a_100000210268_100000693364 [0,0,1,0,0,1|1,0,0]=3 3040 B16R2.2256 c1ccc(cc1)CCOC2CCCSC2 7a_100015962668_100000765856 [0,0,1,0,0,1|1,0,0]=3 3041 B16R2.2256 c1ccc(cc1)CCOC2CCOCC2 34a_100000744328_100000765856 [0,0,1,0,0,1|1,0,0]=3 3042 B16R2.2256 c1ccc(cc1)CCOC2CCOCC2 7a_100000210268_100000686592 [0,0,1,0,0,1|1,0,0]=3 3043 B16R2.2256 c1ccc(cc1)CCOC2CCSCC2 34a_100000210268_100000069128 [0,0,1,0,0,1|1,0,0]=3 3044 B16R2.2256 c1ccc(cc1)CCOC2CCSCC2 34a_100000731022_100000765856 [0,0,1,0,0,1|1,0,0]=3 3045 B16R2.2256 c1ccc(cc1)CCOC2CCSCC2 7a_100000210268_100011500858 [0,0,1,0,0,1|1,0,0]=3 3046 B16R2.2256 c1ccc(cc1)CCOC2CCSCC2 7a_100000731022_100000765856 [0,0,1,0,0,1|1,0,0]=3 3047 B16R2.2256 c1ccc(cc1)CCSC2CCCCC2 62a_100000210327_100011218657 [0,0,1,0,0,1|1,0,0]=3 3048 B16R2.2256 c1ccc(cc1)CCSC2CCCCC2 62a_100000765856_100000210327 [0,0,1,0,0,1|1,0,0]=3 3049 B16R2.2256 c1ccc(cc1)CCSC2CCCOC2 62a_100000765856_100000693364 [0,0,1,0,0,1|1,0,0]=3 3050 B16R2.2256 c1ccc(cc1)CCSC2CCOCC2 62a_100000765856_100011324220 [0,0,1,0,0,1|1,0,0]=3 3051 B16R2.2256 c1ccc(cc1)CCSC2CCSCC2 62a_100000765856_100000069128 [0,0,1,0,0,1|1,0,0]=3 3052 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 207a_100000210473_100015611070 [0,0,1,0,0,1|2,0,0]=4 3053 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 2230a_100000210473_100015291786 [0,0,1,0,0,1|2,0,0]=4 3054 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 2230a_100015324214_100000211423 [0,0,1,0,0,1|2,0,0]=4 3055 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 269862a_100015324214_100000211278 [0,0,1,0,0,1|2,0,0]=4 3056 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 270004a_100000210473_100015611070 [0,0,1,0,0,1|2,0,0]=4 3057 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 34a_100000210473_100015291786 [0,0,1,0,0,1|2,0,0]=4 3058 B16R2.2256 c1ccc(cc1)CNCC2CCCCC2 34a_100015324214_100000211423 [0,0,1,0,0,1|2,0,0]=4 3059 B16R2.2256 c1ccc(cc1)CNCC2CCCCO2 207a_100000174945_100015611070 [0,0,1,0,0,1|2,0,0]=4 3060 B16R2.2256 c1ccc(cc1)CNCC2CCCCO2 2230a_100000174945_100015291786 [0,0,1,0,0,1|2,0,0]=4 3061 B16R2.2256 c1ccc(cc1)CNCC2CCCCO2 2230a_100015324214_100000211543 [0,0,1,0,0,1|2,0,0]=4 3062 B16R2.2256 c1ccc(cc1)CNCC2CCCCO2 270004a_100000174945_100015611070 [0,0,1,0,0,1|2,0,0]=4 3063 B16R2.2256 c1ccc(cc1)CNCC2CCCCO2 34a_100000174945_100015291786 [0,0,1,0,0,1|2,0,0]=4 3064 B16R2.2256 c1ccc(cc1)CNCC2CCCCO2 34a_100015324214_100000211543 [0,0,1,0,0,1|2,0,0]=4 3065 B16R2.2256 c1ccc(cc1)CNCC2CCCOC2 207a_100000720124_100015611070 [0,0,1,0,0,1|2,0,0]=4 3066 B16R2.2256 c1ccc(cc1)CNCC2CCCOC2 2230a_100000720124_100015291786 [0,0,1,0,0,1|2,0,0]=4 3067 B16R2.2256 c1ccc(cc1)CNCC2CCCOC2 2230a_100015324214_100000741521 [0,0,1,0,0,1|2,0,0]=4 3068 B16R2.2256 c1ccc(cc1)CNCC2CCCOC2 270004a_100000720124_100015611070 [0,0,1,0,0,1|2,0,0]=4 3069 B16R2.2256 c1ccc(cc1)CNCC2CCCOC2 34a_100000720124_100015291786 [0,0,1,0,0,1|2,0,0]=4 3070 B16R2.2256 c1ccc(cc1)CNCC2CCCOC2 34a_100015324214_100000741521 [0,0,1,0,0,1|2,0,0]=4 3071 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 207a_100000746373_100015611070 [0,0,1,0,0,1|2,0,0]=4 3072 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 2230a_100000746373_100015291786 [0,0,1,0,0,1|2,0,0]=4 3073 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 2230a_100015324214_100000754603 [0,0,1,0,0,1|2,0,0]=4 3074 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 269862a_100015324214_100000749017 [0,0,1,0,0,1|2,0,0]=4 3075 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 270004a_100000746373_100015611070 [0,0,1,0,0,1|2,0,0]=4 3076 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 34a_100000746373_100015291786 [0,0,1,0,0,1|2,0,0]=4 3077 B16R2.2256 c1ccc(cc1)CNCC2CCOCC2 34a_100015324214_100000754603 [0,0,1,0,0,1|2,0,0]=4 3078 B16R2.2256 c1ccc(cc1)CNCC2CCSCC2 207a_100015188806_100015611070 [0,0,1,0,0,1|2,0,0]=4 3079 B16R2.2256 c1ccc(cc1)CNCC2CCSCC2 2230a_100015188806_100015291786 [0,0,1,0,0,1|2,0,0]=4 3080 B16R2.2256 c1ccc(cc1)CNCC2CCSCC2 269862a_100015324214_100000067145 [0,0,1,0,0,1|2,0,0]=4 3081 B16R2.2256 c1ccc(cc1)CNCC2CCSCC2 270004a_100015188806_100015611070 [0,0,1,0,0,1|2,0,0]=4 3082 B16R2.2256 c1ccc(cc1)CNCC2CCSCC2 270004a_100015324214_100000067145 [0,0,1,0,0,1|2,0,0]=4 3083 B16R2.2256 c1ccc(cc1)CNCC2CCSCC2 34a_100015188806_100015291786 [0,0,1,0,0,1|2,0,0]=4 3084 B16R2.2256 c1ccc(cc1)COCC2CCCCC2 34a_100000210790_100000211423 [0,0,1,0,0,1|2,0,0]=4 3085 B16R2.2256 c1ccc(cc1)COCC2CCCCC2 34a_100000212181_100015291786 [0,0,1,0,0,1|2,0,0]=4 3086 B16R2.2256 c1ccc(cc1)COCC2CCCCC2 7a_100000210790_100000211423 [0,0,1,0,0,1|2,0,0]=4 3087 B16R2.2256 c1ccc(cc1)COCC2CCCCC2 7a_100000212181_100000211182 [0,0,1,0,0,1|2,0,0]=4 3088 B16R2.2256 c1ccc(cc1)COCC2CCCCN2 34a_100000210821_100015291786 [0,0,1,0,0,1|2,0,0]=4 3089 B16R2.2256 c1ccc(cc1)COCC2CCCCO2 34a_100000210790_100000211543 [0,0,1,0,0,1|2,0,0]=4 3090 B16R2.2256 c1ccc(cc1)COCC2CCCCO2 34a_100000211370_100015291786 [0,0,1,0,0,1|2,0,0]=4 3091 B16R2.2256 c1ccc(cc1)COCC2CCCCO2 7a_100000210790_100000211543 [0,0,1,0,0,1|2,0,0]=4 3092 B16R2.2256 c1ccc(cc1)COCC2CCCCO2 7a_100000211370_100000211182 [0,0,1,0,0,1|2,0,0]=4 3093 B16R2.2256 c1ccc(cc1)COCC2CCCNC2 34a_100000211344_100015291786 [0,0,1,0,0,1|2,0,0]=4 3094 B16R2.2256 c1ccc(cc1)COCC2CCCOC2 34a_100000210790_100000741521 [0,0,1,0,0,1|2,0,0]=4 3095 B16R2.2256 c1ccc(cc1)COCC2CCCOC2 34a_100000741520_100015291786 [0,0,1,0,0,1|2,0,0]=4 3096 B16R2.2256 c1ccc(cc1)COCC2CCCOC2 7a_100000210790_100000741521 [0,0,1,0,0,1|2,0,0]=4 3097 B16R2.2256 c1ccc(cc1)COCC2CCNCC2 34a_100000738675_100015291786 [0,0,1,0,0,1|2,0,0]=4 3098 B16R2.2256 c1ccc(cc1)COCC2CCOCC2 34a_100000210790_100000754603 [0,0,1,0,0,1|2,0,0]=4 3099 B16R2.2256 c1ccc(cc1)COCC2CCOCC2 34a_100000749013_100015291786 [0,0,1,0,0,1|2,0,0]=4 3100 B16R2.2256 c1ccc(cc1)COCC2CCOCC2 7a_100000210790_100000754603 [0,0,1,0,0,1|2,0,0]=4 3101 B16R2.2256 c1ccc(cc1)COCC2CCSCC2 34a_100000070558_100015291786 [0,0,1,0,0,1|2,0,0]=4 3102 B16R2.2256 c1ccc(cc1)COCC2CCSCC2 7a_100000070558_100000211182 [0,0,1,0,0,1|2,0,0]=4 3103 B16R2.2256 c1ccc(cc1)CSCC2CCCCC2 62a_100000211182_100000211423 [0,0,1,0,0,1|2,0,0]=4 3104 B16R2.2256 c1ccc(cc1)CSCC2CCCCC2 62a_100000211423_100015291786 [0,0,1,0,0,1|2,0,0]=4 3105 B16R2.2256 c1ccc(cc1)CSCC2CCCCO2 62a_100000211182_100000211543 [0,0,1,0,0,1|2,0,0]=4 3106 B16R2.2256 c1ccc(cc1)CSCC2CCCCO2 62a_100000211543_100015291786 [0,0,1,0,0,1|2,0,0]=4 3107 B16R2.2256 c1ccc(cc1)CSCC2CCCOC2 62a_100000211182_100000741521 [0,0,1,0,0,1|2,0,0]=4 3108 B16R2.2256 c1ccc(cc1)CSCC2CCCOC2 62a_100000741521_100015291786 [0,0,1,0,0,1|2,0,0]=4 3109 B16R2.2256 c1ccc(cc1)CSCC2CCOCC2 62a_100000211182_100000749018 [0,0,1,0,0,1|2,0,0]=4 3110 B16R2.2256 c1ccc(cc1)CSCC2CCOCC2 62a_100000754603_100015291786 [0,0,1,0,0,1|2,0,0]=4 3111 B16R2.2256 c1ccc(cc1)NCCC2CCCCC2 34a_100000106764_100011209188 [0,0,1,0,0,1|2,0,0]=4 3112 B16R2.2256 c1ccc(cc1)NCCC2CCOCC2 34a_100000106764_100011934994 [0,0,1,0,0,1|2,0,0]=4 3113 B16R2.2256 c1ccc(cc1)NCOC2CCCCC2 34a_100000106764_100011935260 [0,0,1,0,0,1|2,0,0]=4 3114 B16R2.2256 c1ccc(cc1)OCCC2CCCCC2 34a_100000210340_100011209188 [0,0,1,0,0,1|2,0,0]=4 3115 B16R2.2256 c1ccc(cc1)OCCC2CCCCC2 7a_100000210340_100011273959 [0,0,1,0,0,1|2,0,0]=4 3116 B16R2.2256 c1ccc(cc1)OCCC2CCOCC2 34a_100000210340_100011934994 [0,0,1,0,0,1|2,0,0]=4 3117 B16R2.2256 c1ccc(cc1)OCCC2CCOCC2 7a_100000210340_100011934994 [0,0,1,0,0,1|2,0,0]=4 3118 B16R2.2256 c1ccc(cc1)OCOC2CCCCC2 34a_100000210340_100011935260 [0,0,1,0,0,1|2,0,0]=4 3119 B16R2.2256 c1ccc(cc1)OCOC2CCCCC2 7a_100000210340_100011935260 [0,0,1,0,0,1|2,0,0]=4 3120 B16R2.2256 c1ccc(cc1)SCCC2CCCCC2 62a_100000719477_100012355289 [0,0,1,0,0,1|2,0,0]=4 3121 B16R2.2256 c1ccc(cc1)SCCC2CCCCC2 62a_100012355289_100000041952 [0,0,1,0,0,1|2,0,0]=4 3122 B16R2.2256 c1ccc(cc1)SCCC2CCOCC2 62a_100000719477_100011934994 [0,0,1,0,0,1|2,0,0]=4 3123 B16R2.2256 c1ccc(cc1)SCCC2CCOCC2 62a_100011934994_100000041952 [0,0,1,0,0,1|2,0,0]=4 3124 B16R2.2256 c1ccc(cc1)SCNC2CCCCC2 2230a_100000182618_100011218342 [0,0,1,0,0,1|1,0,0]=3 3125 B16R2.2256 c1ccc(cc1)SCNC2CCCOC2 2230a_100000719290_100011218342 [0,0,1,0,0,1|1,0,0]=3 3126 B16R2.2256 c1ccc(cc1)SCNC2CCOCC2 2230a_100000741149_100011218342 [0,0,1,0,0,1|1,0,0]=3 3127 B16R2.2256 c1ccc(cc1)SCNC2CCSCC2 2230a_100000748639_100011218342 [0,0,1,0,0,1|1,0,0]=3 3128 B16R2.2256 c1ccc(cc1)SCOC2CCCCC2 62a_100000719477_100011935260 [0,0,1,0,0,1|2,0,0]=4 3129 B16R2.2256 c1ccc(cc1)SCOC2CCCCC2 62a_100011935260_100000041952 [0,0,1,0,0,1|2,0,0]=4 3130 B16R2.2256 c1ccc(cc1)SCSC2CCCCC2 62a_100000210327_100011218342 [0,0,1,0,0,1|2,0,0]=4 3131 B16R2.2256 c1ccc(cc1)SCSC2CCCCC2 62a_100011218342_100000210327 [0,0,1,0,0,1|2,0,0]=4 3132 B16R2.2256 c1ccc(cc1)SCSC2CCCOC2 62a_100011218342_100000693364 [0,0,1,0,0,1|2,0,0]=4 3133 B16R2.2256 c1ccc(cc1)SCSC2CCOCC2 62a_100011218342_100011324220 [0,0,1,0,0,1|2,0,0]=4 3134 B16R2.2256 c1ccc(cc1)SCSC2CCSCC2 62a_100011218342_100000069128 [0,0,1,0,0,1|2,0,0]=4 3135 B16R2.2256 c1ccc(nc1)CCNC2CCCCC2 2230a_100000182618_100015183660 [0,0,1,0,0,1|1,0,0]=3 3136 B16R2.2256 c1ccc(nc1)CCNC2CCCCC2 270004a_100000211156_100000210434 [0,0,1,0,0,1|1,0,0]=3 3137 B16R2.2256 c1ccc(nc1)CCNC2CCCOC2 2230a_100000719290_100015183660 [0,0,1,0,0,1|1,0,0]=3 3138 B16R2.2256 c1ccc(nc1)CCNC2CCCOC2 270004a_100000211156_100000753404 [0,0,1,0,0,1|1,0,0]=3 3139 B16R2.2256 c1ccc(nc1)CCNC2CCCSC2 270004a_100000211156_100000057913 [0,0,1,0,0,1|1,0,0]=3 3140 B16R2.2256 c1ccc(nc1)CCNC2CCNCC2 270004a_100000211156_100015192401 [0,0,1,0,0,1|1,0,0]=3 3141 B16R2.2256 c1ccc(nc1)CCNC2CCOCC2 2230a_100000741149_100015183660 [0,0,1,0,0,1|1,0,0]=3 3142 B16R2.2256 c1ccc(nc1)CCNC2CCOCC2 270004a_100000211156_100011217826 [0,0,1,0,0,1|1,0,0]=3 3143 B16R2.2256 c1ccc(nc1)CCNC2CCSCC2 2230a_100000748639_100015183660 [0,0,1,0,0,1|1,0,0]=3 3144 B16R2.2256 c1ccc(nc1)CCNC2CCSCC2 270004a_100000211156_100000203788 [0,0,1,0,0,1|1,0,0]=3 3145 B16R2.2256 c1ccc(nc1)CCOC2CCCCC2 34a_100000210271_100000210327 [0,0,1,0,0,1|2,0,0]=4 3146 B16R2.2256 c1ccc(nc1)CCOC2CCCCC2 7a_100000210231_100015183660 [0,0,1,0,0,1|2,0,0]=4 3147 B16R2.2256 c1ccc(nc1)CCOC2CCCOC2 34a_100000210271_100000693364 [0,0,1,0,0,1|2,0,0]=4 3148 B16R2.2256 c1ccc(nc1)CCOC2CCCSC2 7a_100015962668_100015183660 [0,0,1,0,0,1|2,0,0]=4 3149 B16R2.2256 c1ccc(nc1)CCOC2CCSCC2 34a_100000210271_100000069128 [0,0,1,0,0,1|2,0,0]=4 3150 B16R2.2256 c1ccc(nc1)CCOC2CCSCC2 7a_100000731022_100015183660 [0,0,1,0,0,1|2,0,0]=4 3151 B16R2.2256 c1ccc(nc1)CCSC2CCCCC2 62a_100000210327_100015183660 [0,0,1,0,0,1|2,0,0]=4 3152 B16R2.2256 c1ccc(nc1)CCSC2CCCCC2 62a_100015183660_100000210327 [0,0,1,0,0,1|2,0,0]=4 3153 B16R2.2256 c1ccc(nc1)CCSC2CCCOC2 62a_100015183660_100000693364 [0,0,1,0,0,1|2,0,0]=4 3154 B16R2.2256 c1ccc(nc1)CCSC2CCOCC2 62a_100015183660_100011324220 [0,0,1,0,0,1|2,0,0]=4 3155 B16R2.2256 c1ccc(nc1)CCSC2CCSCC2 62a_100015183660_100000069128 [0,0,1,0,0,1|2,0,0]=4 3156 B16R2.2256 c1cnc(cn1)CCNC2CCCCC2 270004a_100000723456_100000210434 [0,0,1,0,0,1|2,0,0]=4 3157 B16R2.2256 c1cnc(cn1)CCNC2CCCOC2 270004a_100000723456_100000753404 [0,0,1,0,0,1|2,0,0]=4 3158 B16R2.2256 c1cnc(cn1)CCNC2CCCSC2 270004a_100000723456_100000057913 [0,0,1,0,0,1|2,0,0]=4 3159 B16R2.2256 c1cnc(cn1)CCNC2CCNCC2 270004a_100000723456_100015192401 [0,0,1,0,0,1|2,0,0]=4 3160 B16R2.2256 c1cnc(cn1)CCNC2CCOCC2 270004a_100000723456_100011217826 [0,0,1,0,0,1|2,0,0]=4 3161 B16R2.2256 c1cnc(cn1)CCNC2CCSCC2 270004a_100000723456_100000203788 [0,0,1,0,0,1|2,0,0]=4 3162 B16R2.2256 c1cncc(c1)CCNC2CCCCC2 2230a_100000182618_200011713674 [0,0,1,0,0,1|1,0,0]=3 3163 B16R2.2256 c1cncc(c1)CCNC2CCCCC2 270004a_100000736294_100000210434 [0,0,1,0,0,1|1,0,0]=3 3164 B16R2.2256 c1cncc(c1)CCNC2CCCOC2 2230a_100000719290_200011713674 [0,0,1,0,0,1|1,0,0]=3 3165 B16R2.2256 c1cncc(c1)CCNC2CCCOC2 270004a_100000736294_100000753404 [0,0,1,0,0,1|1,0,0]=3 3166 B16R2.2256 c1cncc(c1)CCNC2CCCSC2 270004a_100000736294_100000057913 [0,0,1,0,0,1|1,0,0]=3 3167 B16R2.2256 c1cncc(c1)CCNC2CCNCC2 270004a_100000736294_100015192401 [0,0,1,0,0,1|1,0,0]=3 3168 B16R2.2256 c1cncc(c1)CCNC2CCOCC2 2230a_100000741149_200011713674 [0,0,1,0,0,1|1,0,0]=3 3169 B16R2.2256 c1cncc(c1)CCNC2CCOCC2 270004a_100000736294_100011217826 [0,0,1,0,0,1|1,0,0]=3 3170 B16R2.2256 c1cncc(c1)CCNC2CCSCC2 2230a_100000748639_200011713674 [0,0,1,0,0,1|1,0,0]=3 3171 B16R2.2256 c1cncc(c1)CCNC2CCSCC2 270004a_100000736294_100000203788 [0,0,1,0,0,1|1,0,0]=3 3172 B16R2.2256 c1cncc(c1)CCOC2CCCCC2 34a_100011217484_100000210327 [0,0,1,0,0,1|2,0,0]=4 3173 B16R2.2256 c1cncc(c1)CCOC2CCCCC2 7a_100000210231_200011713674 [0,0,1,0,0,1|2,0,0]=4 3174 B16R2.2256 c1cncc(c1)CCOC2CCCOC2 34a_100011217484_100000693364 [0,0,1,0,0,1|2,0,0]=4 3175 B16R2.2256 c1cncc(c1)CCOC2CCCSC2 7a_100015962668_200011713674 [0,0,1,0,0,1|2,0,0]=4 3176 B16R2.2256 c1cncc(c1)CCOC2CCSCC2 34a_100011217484_100000069128 [0,0,1,0,0,1|2,0,0]=4 3177 B16R2.2256 c1cncc(c1)CCOC2CCSCC2 7a_100000731022_200011713674 [0,0,1,0,0,1|2,0,0]=4 3178 B16R2.2256 c1cncc(c1)CCSC2CCCCC2 62a_100000210327_200011713674 [0,0,1,0,0,1|2,0,0]=4 3179 B16R2.2256 c1cncc(c1)CCSC2CCCCC2 62a_200011713674_100000210327 [0,0,1,0,0,1|2,0,0]=4 3180 B16R2.2256 c1cncc(c1)CCSC2CCCOC2 62a_200011713674_100000693364 [0,0,1,0,0,1|2,0,0]=4 3181 B16R2.2256 c1cncc(c1)CCSC2CCOCC2 62a_200011713674_100011324220 [0,0,1,0,0,1|2,0,0]=4 3182 B16R2.2256 c1cncc(c1)CCSC2CCSCC2 62a_200011713674_100000069128 [0,0,1,0,0,1|2,0,0]=4 3183 B16R2.2257 C(#Cc1ccccc1)CNC2CCCC2 2230a_100000211070_100011352542 [0,0,1,0,0,1|0,0,1]=3 3184 B16R2.2257 C(#Cc1ccccc1)CNC2CCCC2 34a_100000211070_100011352542 [0,0,1,0,0,1|0,0,1]=3 3185 B16R2.2257 C(#Cc1ccccc1)CNC2CCCC2 34a_100000735379_100000179811 [0,0,1,0,0,1|0,0,1]=3 3186 B16R2.2257 C(#Cc1ccccc1)CNC2CCOC2 34a_100000735379_100000690089 [0,0,1,0,0,1|1,0,1]=4 3187 B16R2.2257 C(#Cc1ccccc1)CN[C@@H]2CCOC2 2230a_200015188469_100011352542 [0,0,1,0,0,1|1,0,1]=4 3188 B16R2.2257 C(#Cc1ccccc1)CN[C@H]2CCOC2 2230a_100015188467_100011352542 [0,0,1,0,0,1|1,0,1]=4 3189 B16R2.2257 C(#Cc1ccccc1)CN[C@H]2CCOC2 34a_100015188467_100011352542 [0,0,1,0,0,1|1,0,1]=4 3190 B16R2.2257 C(#Cc1ccccc1)COC2CCCC2 34a_100000210269_100011352542 [0,0,1,0,0,1|1,0,1]=4 3191 B16R2.2257 C(#Cc1ccccc1)COC2CCCC2 34a_100011217464_100000179811 [0,0,1,0,0,1|1,0,1]=4 3192 B16R2.2257 C(#Cc1ccccc1)COC2CCCC2 7a_100000210269_100011352542 [0,0,1,0,0,1|1,0,1]=4 3193 B16R2.2257 C(#Cc1ccccc1)COC2CCCC2 7a_100011217464_100000179811 [0,0,1,0,0,1|1,0,1]=4 3194 B16R2.2257 C(#Cc1ccccc1)CSC2CCCC2 62a_100011217020_100011352542 [0,0,1,0,0,1|1,0,1]=4 3195 B16R2.2257 C(=C/c1ccccc1)\CNC2CCCC2 2230a_100000211070_100016265936 [0,0,1,0,0,1|0,0,1]=3 3196 B16R2.2257 C(=C/c1ccccc1)\CNC2CCCC2 2230a_100020603302_100000179811 [0,0,1,0,0,1|0,0,1]=3 3197 B16R2.2257 C(=C/c1ccccc1)\CNC2CCCC2 270004a_100020603302_100000210133 [0,0,1,0,0,1|0,0,1]=3 3198 B16R2.2257 C(=C/c1ccccc1)\CNC2CCCC2 34a_100000211070_100016265936 [0,0,1,0,0,1|0,0,1]=3 3199 B16R2.2257 C(=C/c1ccccc1)\CNC2CCCC2 34a_100020603302_100000179811 [0,0,1,0,0,1|0,0,1]=3 3200 B16R2.2257 C(=C/c1ccccc1)\CNC2CCOC2 2230a_100020603302_100000731011 [0,0,1,0,0,1|1,0,1]=4 3201 B16R2.2257 C(=C/c1ccccc1)\CNC2CCOC2 270004a_100020603302_100000752484 [0,0,1,0,0,1|1,0,1]=4 3202 B16R2.2257 C(=C/c1ccccc1)\CNC2CCOC2 34a_100020603302_100000690089 [0,0,1,0,0,1|1,0,1]=4 3203 B16R2.2257 C(=C/c1ccccc1)\CNC2CCSC2 270004a_100020603302_100000212027 [0,0,1,0,0,1|1,0,1]=4 3204 B16R2.2257 C(=C/c1ccccc1)\CN[C@@H]2CCOC2 2230a_200015188469_100016265936 [0,0,1,0,0,1|1,0,1]=4 3205 B16R2.2257 C(=C/c1ccccc1)\CN[C@H]2CCOC2 2230a_100015188467_100016265936 [0,0,1,0,0,1|1,0,1]=4 3206 B16R2.2257 C(=C/c1ccccc1)\CN[C@H]2CCOC2 34a_100015188467_100016265936 [0,0,1,0,0,1|1,0,1]=4 3207 B16R2.2257 C(=C/c1ccccc1)\COC2CCCC2 34a_100000210256_100000179811 [0,0,1,0,0,1|1,0,1]=4 3208 B16R2.2257 C(=C/c1ccccc1)\COC2CCCC2 34a_100000210269_100016265936 [0,0,1,0,0,1|1,0,1]=4 3209 B16R2.2257 C(=C/c1ccccc1)\COC2CCCC2 7a_100000210269_100016265936 [0,0,1,0,0,1|1,0,1]=4 3210 B16R2.2257 C(=C/c1ccccc1)\CSC2CCCC2 62a_100011217020_100016265936 [0,0,1,0,0,1|1,0,1]=4 3211 B16R2.2257 C(=C/c1ccccc1)\CSC2CCCC2 62a_100016265936_100000179811 [0,0,1,0,0,1|1,0,1]=4 3212 B16R2.2257 C(=Cc1ccccc1)CNC2CCCC2 270004a_100000211070_100000210105 [0,0,1,0,0,1|0,0,1]=3 3213 B16R2.2257 C(=Cc1ccccc1)CN[C@@H]2CCOC2 270004a_200015188469_100000210105 [0,0,1,0,0,1|1,0,1]=4 3214 B16R2.2257 C(=Cc1ccccc1)CN[C@H]2CCOC2 270004a_100015188467_100000210105 [0,0,1,0,0,1|1,0,1]=4 3215 B16R2.2257 C(=NNC1CCCC1)Cc2ccccc2 4a_100000737850_100000209964 [0,0,1,0,0,1|0,0,1]=3 3216 B16R2.2257 C(=NNC1CCOC1)Cc2ccccc2 4a_100000690549_100000209964 [0,0,1,0,0,1|1,0,1]=4 3217 B16R2.2257 C(=NNC1CCSC1)Cc2ccccc2 4a_200000731317_100000209964 [0,0,1,0,0,1|1,0,1]=4 3218 B16R2.2257 C(=NNCc1ccccc1)C2CCCC2 4a_100000007032_100000746403 [0,0,1,0,0,1|1,0,1]=4 3219 B16R2.2257 C1=CCC(C1)NCCCc2ccccc2 2230a_100015188752_100000211621 [0,0,1,0,0,1|0,0,2]=4 3220 B16R2.2257 C1=CCC(C1)NCCOc2ccccc2 2230a_100015188752_100000184471 [0,0,1,0,0,1|0,0,2]=4 3221 B16R2.2257 C1=CCC(C1)NCCOc2ccccc2 270004a_100015188752_100000758736 [0,0,1,0,0,1|0,0,2]=4 3222 B16R2.2257 C1=CCC(C1)NCCSc2ccccc2 2230a_100015188752_100000246102 [0,0,1,0,0,1|0,0,2]=4 3223 B16R2.2257 C1=CCC(C1)NCOCc2ccccc2 2230a_100015188752_100000763385 [0,0,1,0,0,1|0,0,2]=4 3224 B16R2.2257 C1=CCC(C1)NCSCc2ccccc2 2230a_100015188752_200011217039 [0,0,1,0,0,1|0,0,2]=4 3225 B16R2.2257 c1cc(ccn1)CCCNC2CCCC2 2230a_100011275580_100000179811 [0,0,1,0,0,1|1,0,0]=3 3226 B16R2.2257 c1cc(ccn1)CCCNC2CCCC2 270004a_100011275580_100000210133 [0,0,1,0,0,1|1,0,0]=3 3227 B16R2.2257 c1cc(ccn1)CCCNC2CCOC2 2230a_100011275580_100000731011 [0,0,1,0,0,1|2,0,0]=4 3228 B16R2.2257 c1cc(ccn1)CCCNC2CCOC2 270004a_100011275580_100000752484 [0,0,1,0,0,1|2,0,0]=4 3229 B16R2.2257 c1cc(ccn1)CCCNC2CCSC2 270004a_100011275580_100000212027 [0,0,1,0,0,1|2,0,0]=4 3230 B16R2.2257 c1cc(ccn1)CCCOC2CCCC2 34a_100000210659_100000179811 [0,0,1,0,0,1|2,0,0]=4 3231 B16R2.2257 c1cc(ccn1)CCNCC2CCCC2 2230a_100000737975_100000723409 [0,0,1,0,0,1|1,0,0]=3 3232 B16R2.2257 c1cc(ccn1)CCNCC2CCCC2 269862a_100000742849_100000746403 [0,0,1,0,0,1|1,0,0]=3 3233 B16R2.2257 c1cc(ccn1)CCNCC2CCOC2 2230a_100000737293_100000723409 [0,0,1,0,0,1|2,0,0]=4 3234 B16R2.2257 c1cc(ccn1)CCNC[C@@H]2CCCO2 2230a_100020590478_100000723409 [0,0,1,0,0,1|2,0,0]=4 3235 B16R2.2257 c1cc(ccn1)CCOCC2CCCC2 34a_100011216225_100000740388 [0,0,1,0,0,1|2,0,0]=4 3236 B16R2.2257 c1cc(ccn1)CCOCC2CCCC2 7a_100000742336_100000723409 [0,0,1,0,0,1|2,0,0]=4 3237 B16R2.2257 c1cc(ccn1)CCSCC2CCCC2 62a_100000723409_100000740388 [0,0,1,0,0,1|2,0,0]=4 3238 B16R2.2257 c1cc(ccn1)CCSCC2CCCC2 62a_100000740388_100000723409 [0,0,1,0,0,1|2,0,0]=4 3239 B16R2.2257 c1cc(ccn1)CNCCC2CCCC2 207a_100000739158_100000186114 [0,0,1,0,0,1|2,0,0]=4 3240 B16R2.2257 c1cc(ccn1)CNCCC2CCCC2 2230a_100000739158_100015193705 [0,0,1,0,0,1|2,0,0]=4 3241 B16R2.2257 c1cc(ccn1)COCCC2CCCC2 7a_100000749090_100015193705 [0,0,1,0,0,1|2,0,0]=4 3242 B16R2.2257 c1cc(ccn1)CSCCC2CCCC2 62a_100000760354_100015193705 [0,0,1,0,0,1|2,0,0]=4 3243 B16R2.2257 c1cc(ccn1)CSCCC2CCCC2 62a_100015193705_100000760354 [0,0,1,0,0,1|2,0,0]=4 3244 B16R2.2257 c1cc(ccn1)NCCOC2CCCC2 34a_200011243140_100000179811 [0,0,1,0,0,1|2,0,0]=4 3245 B16R2.2257 c1cc(ccn1)OCCCC2CCCC2 34a_100000212176_100011713738 [0,0,1,0,0,1|2,0,0]=4 3246 B16R2.2257 c1cc(ccn1)OCCNC2CCCC2 270004a_100025717301_100000210133 [0,0,1,0,0,1|1,0,0]=3 3247 B16R2.2257 c1cc(ccn1)OCCNC2CCOC2 270004a_100025717301_100000752484 [0,0,1,0,0,1|2,0,0]=4 3248 B16R2.2257 c1cc(ccn1)OCCNC2CCSC2 270004a_100025717301_100000212027 [0,0,1,0,0,1|2,0,0]=4 3249 B16R2.2257 c1cc(ccn1)SCCCC2CCCC2 62a_100000728582_100011713738 [0,0,1,0,0,1|2,0,0]=4 3250 B16R2.2257 c1cc(ccn1)SCCCC2CCCC2 62a_100011713738_100000728582 [0,0,1,0,0,1|2,0,0]=4 3251 B16R2.2257 c1ccc(cc1)CCCCN2CCCC2 2230a_100000188435_100000701786 [0,0,1,0,0,1|2,0,0]=4 3252 B16R2.2257 c1ccc(cc1)CCCCN2CCCC2 269982a_100000188435_100000701786 [0,0,1,0,0,1|2,0,0]=4 3253 B16R2.2257 c1ccc(cc1)CCCNC2CCCC2 2230a_100000211070_100000211621 [0,0,1,0,0,1|0,0,0]=2 3254 B16R2.2257 c1ccc(cc1)CCCNC2CCCC2 2230a_100000211184_100000179811 [0,0,1,0,0,1|0,0,0]=2 3255 B16R2.2257 c1ccc(cc1)CCCNC2CCCC2 270004a_100000211184_100000210133 [0,0,1,0,0,1|0,0,0]=2 3256 B16R2.2257 c1ccc(cc1)CCCNC2CCCC2 34a_100000211070_100000211621 [0,0,1,0,0,1|0,0,0]=2 3257 B16R2.2257 c1ccc(cc1)CCCNC2CCCC2 34a_100000211184_100000179811 [0,0,1,0,0,1|0,0,0]=2 3258 B16R2.2257 c1ccc(cc1)CCCNC2CCOC2 2230a_100000211184_100000731011 [0,0,1,0,0,1|1,0,0]=3 3259 B16R2.2257 c1ccc(cc1)CCCNC2CCOC2 270004a_100000211184_100000752484 [0,0,1,0,0,1|1,0,0]=3 3260 B16R2.2257 c1ccc(cc1)CCCNC2CCOC2 34a_100000211184_100000690089 [0,0,1,0,0,1|1,0,0]=3 3261 B16R2.2257 c1ccc(cc1)CCCNC2CCSC2 270004a_100000211184_100000212027 [0,0,1,0,0,1|1,0,0]=3 3262 B16R2.2257 c1ccc(cc1)CCCN[C@@H]2CCOC2 2230a_200015188469_100000211621 [0,0,1,0,0,1|1,0,0]=3 3263 B16R2.2257 c1ccc(cc1)CCCN[C@H]2CCOC2 2230a_100015188467_100000211621 [0,0,1,0,0,1|1,0,0]=3 3264 B16R2.2257 c1ccc(cc1)CCCN[C@H]2CCOC2 34a_100015188467_100000211621 [0,0,1,0,0,1|1,0,0]=3 3265 B16R2.2257 c1ccc(cc1)CCCOC2CCCC2 34a_100000210269_100000211621 [0,0,1,0,0,1|1,0,0]=3 3266 B16R2.2257 c1ccc(cc1)CCCOC2CCCC2 34a_100000210828_100000179811 [0,0,1,0,0,1|1,0,0]=3 3267 B16R2.2257 c1ccc(cc1)CCCOC2CCCC2 7a_100000210269_100000211621 [0,0,1,0,0,1|1,0,0]=3 3268 B16R2.2257 c1ccc(cc1)CCCOC2CCCC2 7a_100000210828_100000179811 [0,0,1,0,0,1|1,0,0]=3 3269 B16R2.2257 c1ccc(cc1)CCCOC2CCCO2 34a_100000085407_100000211621 [0,0,1,0,0,1|2,0,0]=4 3270 B16R2.2257 c1ccc(cc1)CCCOC2CCOC2 34a_100000210828_100000690089 [0,0,1,0,0,1|2,0,0]=4 3271 B16R2.2257 c1ccc(cc1)CCCOC2CCOC2 7a_100000210828_100000731011 [0,0,1,0,0,1|2,0,0]=4 3272 B16R2.2257 c1ccc(cc1)CCCOC2CCSC2 7a_100011232664_100000211621 [0,0,1,0,0,1|2,0,0]=4 3273 B16R2.2257 c1ccc(cc1)CCCO[C@H]2CCOC2 34a_100000717292_100000211621 [0,0,1,0,0,1|2,0,0]=4 3274 B16R2.2257 c1ccc(cc1)CCCSC2CCCC2 62a_100000211621_100000179811 [0,0,1,0,0,1|1,0,0]=3 3275 B16R2.2257 c1ccc(cc1)CCCSC2CCCC2 62a_100011217020_100000211621 [0,0,1,0,0,1|1,0,0]=3 3276 B16R2.2257 c1ccc(cc1)CCCSC2CCOC2 62a_100000211621_100000690089 [0,0,1,0,0,1|2,0,0]=4 3277 B16R2.2257 c1ccc(cc1)CCNCC2CCCC2 2230a_100000106460_100000740388 [0,0,1,0,0,1|0,0,0]=2 3278 B16R2.2257 c1ccc(cc1)CCNCC2CCCC2 2230a_100000737975_100000765856 [0,0,1,0,0,1|0,0,0]=2 3279 B16R2.2257 c1ccc(cc1)CCNCC2CCCC2 269862a_100000106460_100000746403 [0,0,1,0,0,1|0,0,0]=2 3280 B16R2.2257 c1ccc(cc1)CCNCC2CCCC2 34a_100000106460_100000740388 [0,0,1,0,0,1|0,0,0]=2 3281 B16R2.2257 c1ccc(cc1)CCNCC2CCCC2 34a_100000737975_100000765856 [0,0,1,0,0,1|0,0,0]=2 3282 B16R2.2257 c1ccc(cc1)CCNCC2CCCO2 2230a_100000106460_100000203698 [0,0,1,0,0,1|1,0,0]=3 3283 B16R2.2257 c1ccc(cc1)CCNCC2CCOC2 2230a_100000106460_100000702531 [0,0,1,0,0,1|1,0,0]=3 3284 B16R2.2257 c1ccc(cc1)CCNCC2CCOC2 2230a_100000737293_100000765856 [0,0,1,0,0,1|1,0,0]=3 3285 B16R2.2257 c1ccc(cc1)CCNCC2CCOC2 34a_100000106460_100011261433 [0,0,1,0,0,1|1,0,0]=3 3286 B16R2.2257 c1ccc(cc1)CCNCC2CCOC2 34a_100000737293_100000765856 [0,0,1,0,0,1|1,0,0]=3 3287 B16R2.2257 c1ccc(cc1)CCNCC2OCCO2 2230a_100000036311_100000765856 [0,0,1,0,0,1|2,0,0]=4 3288 B16R2.2257 c1ccc(cc1)CCNCC2OCCO2 2230a_100000106460_100000755774 [0,0,1,0,0,1|2,0,0]=4 3289 B16R2.2257 c1ccc(cc1)CCNCC2OCCO2 34a_100000036311_100000765856 [0,0,1,0,0,1|2,0,0]=4 3290 B16R2.2257 c1ccc(cc1)CCNCC2OCCO2 34a_100000106460_100000755774 [0,0,1,0,0,1|2,0,0]=4 3291 B16R2.2257 c1ccc(cc1)CCNC[C@@H]2CCCO2 2230a_100020590478_100000765856 [0,0,1,0,0,1|1,0,0]=3 3292 B16R2.2257 c1ccc(cc1)CCNC[C@@H]2CCCO2 34a_100020590478_100000765856 [0,0,1,0,0,1|1,0,0]=3 3293 B16R2.2257 c1ccc(cc1)CCNN=C2CCCC2 4a_100000740470_100000210133 [0,0,1,0,0,1|0,0,1]=3 3294 B16R2.2257 c1ccc(cc1)CCNN=C2CCOC2 4a_100000740470_100000752484 [0,0,1,0,0,1|1,0,1]=4 3295 B16R2.2257 c1ccc(cc1)CCNN=C2CCSC2 4a_100000740470_100000212027 [0,0,1,0,0,1|1,0,1]=4 3296 B16R2.2257 c1ccc(cc1)CCOCC2CCCC2 34a_100000210268_100000740388 [0,0,1,0,0,1|1,0,0]=3 3297 B16R2.2257 c1ccc(cc1)CCOCC2CCCC2 34a_100000742336_100000765856 [0,0,1,0,0,1|1,0,0]=3 3298 B16R2.2257 c1ccc(cc1)CCOCC2CCCC2 7a_100000210268_100000740388 [0,0,1,0,0,1|1,0,0]=3 3299 B16R2.2257 c1ccc(cc1)CCOCC2CCCC2 7a_100000742336_100000765856 [0,0,1,0,0,1|1,0,0]=3 3300 B16R2.2257 c1ccc(cc1)CCOCC2CCCO2 34a_100000210270_100000765856 [0,0,1,0,0,1|2,0,0]=4 3301 B16R2.2257 c1ccc(cc1)CCOCC2CCCO2 7a_100000210268_100000203698 [0,0,1,0,0,1|2,0,0]=4 3302 B16R2.2257 c1ccc(cc1)CCOCC2CCCO2 7a_100000210270_100000765856 [0,0,1,0,0,1|2,0,0]=4 3303 B16R2.2257 c1ccc(cc1)CCOCC2CCNC2 34a_100000748654_100000765856 [0,0,1,0,0,1|2,0,0]=4 3304 B16R2.2257 c1ccc(cc1)CCOCC2CCOC2 34a_100000210268_100011261433 [0,0,1,0,0,1|2,0,0]=4 3305 B16R2.2257 c1ccc(cc1)CCOCC2CCOC2 34a_100000740260_100000765856 [0,0,1,0,0,1|2,0,0]=4 3306 B16R2.2257 c1ccc(cc1)CCOCC2CCOC2 7a_100000210268_100000702531 [0,0,1,0,0,1|2,0,0]=4 3307 B16R2.2257 c1ccc(cc1)CCOC[C@H]2CCCN2 34a_100000745186_100000765856 [0,0,1,0,0,1|2,0,0]=4 3308 B16R2.2257 c1ccc(cc1)CCSCC2CCCC2 62a_100000740388_100011218657 [0,0,1,0,0,1|1,0,0]=3 3309 B16R2.2257 c1ccc(cc1)CCSCC2CCCC2 62a_100000765856_100000740388 [0,0,1,0,0,1|1,0,0]=3 3310 B16R2.2257 c1ccc(cc1)CCSCC2CCCO2 62a_100000203698_100011218657 [0,0,1,0,0,1|2,0,0]=4 3311 B16R2.2257 c1ccc(cc1)CCSCC2CCCO2 62a_100000765856_100000203698 [0,0,1,0,0,1|2,0,0]=4 3312 B16R2.2257 c1ccc(cc1)CCSCC2CCOC2 62a_100000702531_100011218657 [0,0,1,0,0,1|2,0,0]=4 3313 B16R2.2257 c1ccc(cc1)CCSCC2CCOC2 62a_100000765856_100000702531 [0,0,1,0,0,1|2,0,0]=4 3314 B16R2.2257 c1ccc(cc1)CNCCC2CCCC2 207a_100000739158_100015611070 [0,0,1,0,0,1|1,0,0]=3 3315 B16R2.2257 c1ccc(cc1)CNCCC2CCCC2 2230a_100000739158_100015291786 [0,0,1,0,0,1|1,0,0]=3 3316 B16R2.2257 c1ccc(cc1)CNCCC2CCCC2 2230a_100015324214_100000760354 [0,0,1,0,0,1|1,0,0]=3 3317 B16R2.2257 c1ccc(cc1)CNCCC2CCCC2 270004a_100000739158_100015611070 [0,0,1,0,0,1|1,0,0]=3 3318 B16R2.2257 c1ccc(cc1)CNCCC2CCCC2 34a_100000739158_100015291786 [0,0,1,0,0,1|1,0,0]=3 3319 B16R2.2257 c1ccc(cc1)CNCCC2CCCC2 34a_100015324214_100000760354 [0,0,1,0,0,1|1,0,0]=3 3320 B16R2.2257 c1ccc(cc1)CNCCN2CCCC2 207a_100000212299_100015611070 [0,0,1,0,0,1|2,0,0]=4 3321 B16R2.2257 c1ccc(cc1)CNCCN2CCCC2 270004a_100000212299_100015611070 [0,0,1,0,0,1|2,0,0]=4 3322 B16R2.2257 c1ccc(cc1)COCCC2CCCC2 34a_100000210790_100000760354 [0,0,1,0,0,1|1,0,0]=3 3323 B16R2.2257 c1ccc(cc1)COCCC2CCCC2 34a_100000749090_100015291786 [0,0,1,0,0,1|1,0,0]=3 3324 B16R2.2257 c1ccc(cc1)COCCC2CCCC2 7a_100000210790_100000760354 [0,0,1,0,0,1|1,0,0]=3 3325 B16R2.2257 c1ccc(cc1)COCCC2CCCC2 7a_100000749090_100000211182 [0,0,1,0,0,1|1,0,0]=3 3326 B16R2.2257 c1ccc(cc1)COCCC2CCNC2 34a_100016987287_100015291786 [0,0,1,0,0,1|2,0,0]=4 3327 B16R2.2257 c1ccc(cc1)COCCC2CCOC2 34a_100011879284_100015291786 [0,0,1,0,0,1|2,0,0]=4 3328 B16R2.2257 c1ccc(cc1)COCCN2CCCC2 2230a_100000188435_100000234347 [0,0,1,0,0,1|2,0,0]=4 3329 B16R2.2257 c1ccc(cc1)COCCN2CCCC2 269982a_100000188435_100000234347 [0,0,1,0,0,1|2,0,0]=4 3330 B16R2.2257 c1ccc(cc1)COCCN2CCCC2 7a_100000210790_100000004467 [0,0,1,0,0,1|2,0,0]=4 3331 B16R2.2257 c1ccc(cc1)COCNC2CCCC2 2230a_100000211070_100000763385 [0,0,1,0,0,1|0,0,0]=2 3332 B16R2.2257 c1ccc(cc1)COCNC2CCCC2 34a_100000211070_100000763385 [0,0,1,0,0,1|0,0,0]=2 3333 B16R2.2257 c1ccc(cc1)COCN[C@@H]2CCOC2 2230a_200015188469_100000763385 [0,0,1,0,0,1|1,0,0]=3 3334 B16R2.2257 c1ccc(cc1)COCN[C@H]2CCOC2 2230a_100015188467_100000763385 [0,0,1,0,0,1|1,0,0]=3 3335 B16R2.2257 c1ccc(cc1)COCN[C@H]2CCOC2 34a_100015188467_100000763385 [0,0,1,0,0,1|1,0,0]=3 3336 B16R2.2257 c1ccc(cc1)COCOC2CCCC2 34a_100000210269_100000763385 [0,0,1,0,0,1|1,0,0]=3 3337 B16R2.2257 c1ccc(cc1)COCOC2CCCO2 34a_100000085407_100000763385 [0,0,1,0,0,1|2,0,0]=4 3338 B16R2.2257 c1ccc(cc1)COCO[C@H]2CCOC2 34a_100000717292_100000763385 [0,0,1,0,0,1|2,0,0]=4 3339 B16R2.2257 c1ccc(cc1)COCSC2CCCC2 62a_100000763385_100000179811 [0,0,1,0,0,1|1,0,0]=3 3340 B16R2.2257 c1ccc(cc1)COCSC2CCCC2 62a_100011217020_100000763385 [0,0,1,0,0,1|1,0,0]=3 3341 B16R2.2257 c1ccc(cc1)COCSC2CCOC2 62a_100000763385_100000690089 [0,0,1,0,0,1|2,0,0]=4 3342 B16R2.2257 c1ccc(cc1)CSCCC2CCCC2 62a_100000211182_100000760354 [0,0,1,0,0,1|1,0,0]=3 3343 B16R2.2257 c1ccc(cc1)CSCCC2CCCC2 62a_100000760354_100015291786 [0,0,1,0,0,1|1,0,0]=3 3344 B16R2.2257 c1ccc(cc1)CSCCN2CCCC2 2230a_100000188435_200011297719 [0,0,1,0,0,1|2,0,0]=4 3345 B16R2.2257 c1ccc(cc1)CSCCN2CCCC2 269982a_100000188435_200011297719 [0,0,1,0,0,1|2,0,0]=4 3346 B16R2.2257 c1ccc(cc1)CSCCN2CCCC2 62a_100000211182_100000004467 [0,0,1,0,0,1|2,0,0]=4 3347 B16R2.2257 c1ccc(cc1)CSCCN2CCCC2 62a_100000700749_100015291786 [0,0,1,0,0,1|2,0,0]=4 3348 B16R2.2257 c1ccc(cc1)CSCNC2CCCC2 2230a_100000211070_200011217039 [0,0,1,0,0,1|0,0,0]=2 3349 B16R2.2257 c1ccc(cc1)CSCNC2CCCC2 34a_100000211070_200011217039 [0,0,1,0,0,1|0,0,0]=2 3350 B16R2.2257 c1ccc(cc1)CSCN[C@@H]2CCOC2 2230a_200015188469_200011217039 [0,0,1,0,0,1|1,0,0]=3 3351 B16R2.2257 c1ccc(cc1)CSCN[C@H]2CCOC2 2230a_100015188467_200011217039 [0,0,1,0,0,1|1,0,0]=3 3352 B16R2.2257 c1ccc(cc1)CSCN[C@H]2CCOC2 34a_100015188467_200011217039 [0,0,1,0,0,1|1,0,0]=3 3353 B16R2.2257 c1ccc(cc1)CSCOC2CCCC2 34a_100000210269_200011217039 [0,0,1,0,0,1|1,0,0]=3 3354 B16R2.2257 c1ccc(cc1)CSCOC2CCCO2 34a_100000085407_200011217039 [0,0,1,0,0,1|2,0,0]=4 3355 B16R2.2257 c1ccc(cc1)CSCO[C@H]2CCOC2 34a_100000717292_200011217039 [0,0,1,0,0,1|2,0,0]=4 3356 B16R2.2257 c1ccc(cc1)CSCSC2CCCC2 62a_100011217020_200011217039 [0,0,1,0,0,1|1,0,0]=3 3357 B16R2.2257 c1ccc(cc1)CSCSC2CCCC2 62a_200011217039_100000179811 [0,0,1,0,0,1|1,0,0]=3 3358 B16R2.2257 c1ccc(cc1)CSCSC2CCOC2 62a_200011217039_100000690089 [0,0,1,0,0,1|2,0,0]=4 3359 B16R2.2257 c1ccc(cc1)NCCCC2CCCC2 34a_100000106764_100011713738 [0,0,1,0,0,1|1,0,0]=3 3360 B16R2.2257 c1ccc(cc1)NCCCN2CCCC2 34a_100000106764_100016991639 [0,0,1,0,0,1|2,0,0]=4 3361 B16R2.2257 c1ccc(cc1)NCCOC2CCCC2 34a_100000211345_100000179811 [0,0,1,0,0,1|1,0,0]=3 3362 B16R2.2257 c1ccc(cc1)NCCOC2CCOC2 34a_100000211345_100000690089 [0,0,1,0,0,1|2,0,0]=4 3363 B16R2.2257 c1ccc(cc1)OCCCC2CCCC2 34a_100000210340_100011713738 [0,0,1,0,0,1|1,0,0]=3 3364 B16R2.2257 c1ccc(cc1)OCCCC2CCCC2 7a_100000210340_100011713738 [0,0,1,0,0,1|1,0,0]=3 3365 B16R2.2257 c1ccc(cc1)OCCCN2CCCC2 2230a_100000188435_100000199009 [0,0,1,0,0,1|2,0,0]=4 3366 B16R2.2257 c1ccc(cc1)OCCCN2CCCC2 269982a_100000188435_100000199009 [0,0,1,0,0,1|2,0,0]=4 3367 B16R2.2257 c1ccc(cc1)OCCCN2CCCC2 34a_100000210340_100016991639 [0,0,1,0,0,1|2,0,0]=4 3368 B16R2.2257 c1ccc(cc1)OCCCN2CCCC2 7a_100000210340_100011445909 [0,0,1,0,0,1|2,0,0]=4 3369 B16R2.2257 c1ccc(cc1)OCCNC2CCCC2 2230a_100000174943_100000179811 [0,0,1,0,0,1|0,0,0]=2 3370 B16R2.2257 c1ccc(cc1)OCCNC2CCCC2 2230a_100000211070_100000184471 [0,0,1,0,0,1|0,0,0]=2 3371 B16R2.2257 c1ccc(cc1)OCCNC2CCCC2 270004a_100000174943_100000210133 [0,0,1,0,0,1|0,0,0]=2 3372 B16R2.2257 c1ccc(cc1)OCCNC2CCCC2 270004a_100000211070_100000758736 [0,0,1,0,0,1|0,0,0]=2 3373 B16R2.2257 c1ccc(cc1)OCCNC2CCCC2 34a_100000174943_100000179811 [0,0,1,0,0,1|0,0,0]=2 3374 B16R2.2257 c1ccc(cc1)OCCNC2CCCC2 34a_100000211070_100000184471 [0,0,1,0,0,1|0,0,0]=2 3375 B16R2.2257 c1ccc(cc1)OCCNC2CCOC2 2230a_100000174943_100000731011 [0,0,1,0,0,1|1,0,0]=3 3376 B16R2.2257 c1ccc(cc1)OCCNC2CCOC2 270004a_100000174943_100000752484 [0,0,1,0,0,1|1,0,0]=3 3377 B16R2.2257 c1ccc(cc1)OCCNC2CCOC2 34a_100000174943_100000690089 [0,0,1,0,0,1|1,0,0]=3 3378 B16R2.2257 c1ccc(cc1)OCCNC2CCSC2 270004a_100000174943_100000212027 [0,0,1,0,0,1|1,0,0]=3 3379 B16R2.2257 c1ccc(cc1)OCCN[C@@H]2CCOC2 2230a_200015188469_100000184471 [0,0,1,0,0,1|1,0,0]=3 3380 B16R2.2257 c1ccc(cc1)OCCN[C@@H]2CCOC2 270004a_200015188469_100000758736 [0,0,1,0,0,1|1,0,0]=3 3381 B16R2.2257 c1ccc(cc1)OCCN[C@H]2CCOC2 2230a_100015188467_100000184471 [0,0,1,0,0,1|1,0,0]=3 3382 B16R2.2257 c1ccc(cc1)OCCN[C@H]2CCOC2 270004a_100015188467_100000758736 [0,0,1,0,0,1|1,0,0]=3 3383 B16R2.2257 c1ccc(cc1)OCCN[C@H]2CCOC2 34a_100015188467_100000184471 [0,0,1,0,0,1|1,0,0]=3 3384 B16R2.2257 c1ccc(cc1)OCCOC2CCCC2 34a_100000210260_100000179811 [0,0,1,0,0,1|1,0,0]=3 3385 B16R2.2257 c1ccc(cc1)OCCOC2CCCC2 34a_100000210269_100000184471 [0,0,1,0,0,1|1,0,0]=3 3386 B16R2.2257 c1ccc(cc1)OCCOC2CCCC2 7a_100000210260_100000179811 [0,0,1,0,0,1|1,0,0]=3 3387 B16R2.2257 c1ccc(cc1)OCCOC2CCCC2 7a_100000210269_100000184471 [0,0,1,0,0,1|1,0,0]=3 3388 B16R2.2257 c1ccc(cc1)OCCOC2CCCO2 34a_100000085407_100000184471 [0,0,1,0,0,1|2,0,0]=4 3389 B16R2.2257 c1ccc(cc1)OCCOC2CCOC2 34a_100000210260_100000690089 [0,0,1,0,0,1|2,0,0]=4 3390 B16R2.2257 c1ccc(cc1)OCCOC2CCOC2 7a_100000210260_100000731011 [0,0,1,0,0,1|2,0,0]=4 3391 B16R2.2257 c1ccc(cc1)OCCOC2CCSC2 7a_100011232664_100000184471 [0,0,1,0,0,1|2,0,0]=4 3392 B16R2.2257 c1ccc(cc1)OCCO[C@H]2CCOC2 34a_100000717292_100000184471 [0,0,1,0,0,1|2,0,0]=4 3393 B16R2.2257 c1ccc(cc1)OCCSC2CCCC2 62a_100000184471_100000179811 [0,0,1,0,0,1|1,0,0]=3 3394 B16R2.2257 c1ccc(cc1)OCCSC2CCCC2 62a_100011217020_100000184471 [0,0,1,0,0,1|1,0,0]=3 3395 B16R2.2257 c1ccc(cc1)OCCSC2CCOC2 62a_100000184471_100000690089 [0,0,1,0,0,1|2,0,0]=4 3396 B16R2.2257 c1ccc(cc1)SCCCC2CCCC2 62a_100000719477_100011713738 [0,0,1,0,0,1|1,0,0]=3 3397 B16R2.2257 c1ccc(cc1)SCCCC2CCCC2 62a_100011713738_100000041952 [0,0,1,0,0,1|1,0,0]=3 3398 B16R2.2257 c1ccc(cc1)SCCCN2CCCC2 2230a_100000188435_200011203293 [0,0,1,0,0,1|2,0,0]=4 3399 B16R2.2257 c1ccc(cc1)SCCCN2CCCC2 269982a_100000188435_200011203293 [0,0,1,0,0,1|2,0,0]=4 3400 B16R2.2257 c1ccc(cc1)SCCCN2CCCC2 62a_100000719477_100011445909 [0,0,1,0,0,1|2,0,0]=4 3401 B16R2.2257 c1ccc(cc1)SCCCN2CCCC2 62a_100016991639_100000041952 [0,0,1,0,0,1|2,0,0]=4 3402 B16R2.2257 c1ccc(cc1)SCCNC2CCCC2 2230a_100000189519_100000179811 [0,0,1,0,0,1|0,0,0]=2 3403 B16R2.2257 c1ccc(cc1)SCCNC2CCCC2 2230a_100000211070_100000246102 [0,0,1,0,0,1|0,0,0]=2 3404 B16R2.2257 c1ccc(cc1)SCCNC2CCCC2 270004a_100000189519_100000210133 [0,0,1,0,0,1|0,0,0]=2 3405 B16R2.2257 c1ccc(cc1)SCCNC2CCCC2 34a_100000211070_100000246102 [0,0,1,0,0,1|0,0,0]=2 3406 B16R2.2257 c1ccc(cc1)SCCNC2CCOC2 2230a_100000189519_100000731011 [0,0,1,0,0,1|1,0,0]=3 3407 B16R2.2257 c1ccc(cc1)SCCNC2CCOC2 270004a_100000189519_100000752484 [0,0,1,0,0,1|1,0,0]=3 3408 B16R2.2257 c1ccc(cc1)SCCNC2CCSC2 270004a_100000189519_100000212027 [0,0,1,0,0,1|1,0,0]=3 3409 B16R2.2257 c1ccc(cc1)SCCN[C@@H]2CCOC2 2230a_200015188469_100000246102 [0,0,1,0,0,1|1,0,0]=3 3410 B16R2.2257 c1ccc(cc1)SCCN[C@H]2CCOC2 2230a_100015188467_100000246102 [0,0,1,0,0,1|1,0,0]=3 3411 B16R2.2257 c1ccc(cc1)SCCN[C@H]2CCOC2 34a_100015188467_100000246102 [0,0,1,0,0,1|1,0,0]=3 3412 B16R2.2257 c1ccc(cc1)SCCOC2CCCC2 34a_100000210269_100000246102 [0,0,1,0,0,1|1,0,0]=3 3413 B16R2.2257 c1ccc(cc1)SCCOC2CCCC2 7a_100000210269_100000246102 [0,0,1,0,0,1|1,0,0]=3 3414 B16R2.2257 c1ccc(cc1)SCCOC2CCCC2 7a_100000230494_100000179811 [0,0,1,0,0,1|1,0,0]=3 3415 B16R2.2257 c1ccc(cc1)SCCOC2CCCO2 34a_100000085407_100000246102 [0,0,1,0,0,1|2,0,0]=4 3416 B16R2.2257 c1ccc(cc1)SCCOC2CCOC2 7a_100000230494_100000731011 [0,0,1,0,0,1|2,0,0]=4 3417 B16R2.2257 c1ccc(cc1)SCCOC2CCSC2 7a_100011232664_100000246102 [0,0,1,0,0,1|2,0,0]=4 3418 B16R2.2257 c1ccc(cc1)SCCO[C@H]2CCOC2 34a_100000717292_100000246102 [0,0,1,0,0,1|2,0,0]=4 3419 B16R2.2257 c1ccc(cc1)SCCSC2CCCC2 62a_100000246102_100000179811 [0,0,1,0,0,1|1,0,0]=3 3420 B16R2.2257 c1ccc(cc1)SCCSC2CCCC2 62a_100011217020_100000246102 [0,0,1,0,0,1|1,0,0]=3 3421 B16R2.2257 c1ccc(cc1)SCCSC2CCOC2 62a_100000246102_100000690089 [0,0,1,0,0,1|2,0,0]=4 3422 B16R2.2257 c1ccc(cc1)SCNCC2CCCC2 2230a_100000737975_100011218342 [0,0,1,0,0,1|1,0,0]=3 3423 B16R2.2257 c1ccc(cc1)SCNCC2CCOC2 2230a_100000737293_100011218342 [0,0,1,0,0,1|2,0,0]=4 3424 B16R2.2257 c1ccc(cc1)SCNC[C@@H]2CCCO2 2230a_100020590478_100011218342 [0,0,1,0,0,1|2,0,0]=4 3425 B16R2.2257 c1ccc(cc1)SCSCC2CCCC2 62a_100000740388_100011218342 [0,0,1,0,0,1|2,0,0]=4 3426 B16R2.2257 c1ccc(cc1)SCSCC2CCCC2 62a_100011218342_100000740388 [0,0,1,0,0,1|2,0,0]=4 3427 B16R2.2257 c1ccc(nc1)CCCNC2CCCC2 270004a_100000689020_100000210133 [0,0,1,0,0,1|1,0,0]=3 3428 B16R2.2257 c1ccc(nc1)CCCNC2CCOC2 270004a_100000689020_100000752484 [0,0,1,0,0,1|2,0,0]=4 3429 B16R2.2257 c1ccc(nc1)CCCNC2CCSC2 270004a_100000689020_100000212027 [0,0,1,0,0,1|2,0,0]=4 3430 B16R2.2257 c1ccc(nc1)CCCOC2CCCC2 34a_100011215068_100000179811 [0,0,1,0,0,1|2,0,0]=4 3431 B16R2.2257 c1ccc(nc1)CCNCC2CCCC2 2230a_100000737975_100015183660 [0,0,1,0,0,1|1,0,0]=3 3432 B16R2.2257 c1ccc(nc1)CCNCC2CCCC2 269862a_100000211156_100000746403 [0,0,1,0,0,1|1,0,0]=3 3433 B16R2.2257 c1ccc(nc1)CCNCC2CCOC2 2230a_100000737293_100015183660 [0,0,1,0,0,1|2,0,0]=4 3434 B16R2.2257 c1ccc(nc1)CCNC[C@@H]2CCCO2 2230a_100020590478_100015183660 [0,0,1,0,0,1|2,0,0]=4 3435 B16R2.2257 c1ccc(nc1)CCOCC2CCCC2 34a_100000210271_100000740388 [0,0,1,0,0,1|2,0,0]=4 3436 B16R2.2257 c1ccc(nc1)CCOCC2CCCC2 7a_100000742336_100015183660 [0,0,1,0,0,1|2,0,0]=4 3437 B16R2.2257 c1ccc(nc1)CCSCC2CCCC2 62a_100000740388_100015183660 [0,0,1,0,0,1|2,0,0]=4 3438 B16R2.2257 c1ccc(nc1)CCSCC2CCCC2 62a_100015183660_100000740388 [0,0,1,0,0,1|2,0,0]=4 3439 B16R2.2257 c1ccc(nc1)CNCCC2CCCC2 207a_100000739158_100000209966 [0,0,1,0,0,1|2,0,0]=4 3440 B16R2.2257 c1ccc(nc1)CNCCC2CCCC2 2230a_100000739158_100000721315 [0,0,1,0,0,1|2,0,0]=4 3441 B16R2.2257 c1ccc(nc1)CNCCC2CCCC2 270004a_100000739158_100000209966 [0,0,1,0,0,1|2,0,0]=4 3442 B16R2.2257 c1ccc(nc1)CNCCC2CCCC2 34a_100000739158_100000721315 [0,0,1,0,0,1|2,0,0]=4 3443 B16R2.2257 c1ccc(nc1)COCCC2CCCC2 34a_100000749090_100000721315 [0,0,1,0,0,1|2,0,0]=4 3444 B16R2.2257 c1ccc(nc1)COCCC2CCCC2 7a_100000749090_100000721315 [0,0,1,0,0,1|2,0,0]=4 3445 B16R2.2257 c1ccc(nc1)CSCCC2CCCC2 62a_100000721315_100000760354 [0,0,1,0,0,1|2,0,0]=4 3446 B16R2.2257 c1ccc(nc1)CSCCC2CCCC2 62a_100000760354_100000721315 [0,0,1,0,0,1|2,0,0]=4 3447 B16R2.2257 c1ccc(nc1)OCCNC2CCCC2 2230a_106741647558_100000179811 [0,0,1,0,0,1|1,0,0]=3 3448 B16R2.2257 c1ccc(nc1)OCCNC2CCCC2 270004a_106741647558_100000210133 [0,0,1,0,0,1|1,0,0]=3 3449 B16R2.2257 c1ccc(nc1)OCCNC2CCOC2 2230a_106741647558_100000731011 [0,0,1,0,0,1|2,0,0]=4 3450 B16R2.2257 c1ccc(nc1)OCCNC2CCOC2 270004a_106741647558_100000752484 [0,0,1,0,0,1|2,0,0]=4 3451 B16R2.2257 c1ccc(nc1)OCCNC2CCSC2 270004a_106741647558_100000212027 [0,0,1,0,0,1|2,0,0]=4 3452 B16R2.2257 c1ccc(nc1)SCCCC2CCCC2 62a_100011216584_100011713738 [0,0,1,0,0,1|2,0,0]=4 3453 B16R2.2257 c1ccc(nc1)SCCCC2CCCC2 62a_100011713738_100011216584 [0,0,1,0,0,1|2,0,0]=4 3454 B16R2.2257 c1ccc(nc1)SCCOC2CCCC2 7a_100000156319_100000179811 [0,0,1,0,0,1|2,0,0]=4 3455 B16R2.2257 c1cnc(cn1)CCNCC2CCCC2 269862a_100000723456_100000746403 [0,0,1,0,0,1|2,0,0]=4 3456 B16R2.2257 c1cncc(c1)CCCNC2CCCC2 2230a_100011532358_100000179811 [0,0,1,0,0,1|1,0,0]=3 3457 B16R2.2257 c1cncc(c1)CCCNC2CCCC2 270004a_100011532358_100000210133 [0,0,1,0,0,1|1,0,0]=3 3458 B16R2.2257 c1cncc(c1)CCCNC2CCCC2 34a_100011532358_100000179811 [0,0,1,0,0,1|1,0,0]=3 3459 B16R2.2257 c1cncc(c1)CCCNC2CCOC2 2230a_100011532358_100000731011 [0,0,1,0,0,1|2,0,0]=4 3460 B16R2.2257 c1cncc(c1)CCCNC2CCOC2 270004a_100011532358_100000752484 [0,0,1,0,0,1|2,0,0]=4 3461 B16R2.2257 c1cncc(c1)CCCNC2CCOC2 34a_100011532358_100000690089 [0,0,1,0,0,1|2,0,0]=4 3462 B16R2.2257 c1cncc(c1)CCCNC2CCSC2 270004a_100011532358_100000212027 [0,0,1,0,0,1|2,0,0]=4 3463 B16R2.2257 c1cncc(c1)CCCOC2CCCC2 34a_100000211284_100000179811 [0,0,1,0,0,1|2,0,0]=4 3464 B16R2.2257 c1cncc(c1)CCNCC2CCCC2 2230a_100000736294_100000740388 [0,0,1,0,0,1|1,0,0]=3 3465 B16R2.2257 c1cncc(c1)CCNCC2CCCC2 2230a_100000737975_200011713674 [0,0,1,0,0,1|1,0,0]=3 3466 B16R2.2257 c1cncc(c1)CCNCC2CCCC2 269862a_100000736294_100000746403 [0,0,1,0,0,1|1,0,0]=3 3467 B16R2.2257 c1cncc(c1)CCNCC2CCCO2 2230a_100000736294_100000203698 [0,0,1,0,0,1|2,0,0]=4 3468 B16R2.2257 c1cncc(c1)CCNCC2CCOC2 2230a_100000736294_100000702531 [0,0,1,0,0,1|2,0,0]=4 3469 B16R2.2257 c1cncc(c1)CCNCC2CCOC2 2230a_100000737293_200011713674 [0,0,1,0,0,1|2,0,0]=4 3470 B16R2.2257 c1cncc(c1)CCNC[C@@H]2CCCO2 2230a_100020590478_200011713674 [0,0,1,0,0,1|2,0,0]=4 3471 B16R2.2257 c1cncc(c1)CCOCC2CCCC2 34a_100011217484_100000740388 [0,0,1,0,0,1|2,0,0]=4 3472 B16R2.2257 c1cncc(c1)CCOCC2CCCC2 7a_100000742336_200011713674 [0,0,1,0,0,1|2,0,0]=4 3473 B16R2.2257 c1cncc(c1)CCSCC2CCCC2 62a_100000740388_200011713674 [0,0,1,0,0,1|2,0,0]=4 3474 B16R2.2257 c1cncc(c1)CCSCC2CCCC2 62a_200011713674_100000740388 [0,0,1,0,0,1|2,0,0]=4 3475 B16R2.2257 c1cncc(c1)CNCCC2CCCC2 207a_100000739158_100000209961 [0,0,1,0,0,1|2,0,0]=4 3476 B16R2.2257 c1cncc(c1)CNCCC2CCCC2 2230a_100000739158_100000741622 [0,0,1,0,0,1|2,0,0]=4 3477 B16R2.2257 c1cncc(c1)CNCCC2CCCC2 270004a_100000739158_100000209961 [0,0,1,0,0,1|2,0,0]=4 3478 B16R2.2257 c1cncc(c1)CNCCC2CCCC2 34a_100000739158_100000733263 [0,0,1,0,0,1|2,0,0]=4 3479 B16R2.2257 c1cncc(c1)COCCC2CCCC2 34a_100000749090_100000733263 [0,0,1,0,0,1|2,0,0]=4 3480 B16R2.2257 c1cncc(c1)COCCC2CCCC2 7a_100000749090_100000741622 [0,0,1,0,0,1|2,0,0]=4 3481 B16R2.2257 c1cncc(c1)CSCCC2CCCC2 62a_100000741622_100000760354 [0,0,1,0,0,1|2,0,0]=4 3482 B16R2.2257 c1cncc(c1)CSCCC2CCCC2 62a_100000760354_100000741622 [0,0,1,0,0,1|2,0,0]=4 3483 B16R2.2257 c1cncc(c1)OCCCC2CCCC2 34a_100000210849_100011713738 [0,0,1,0,0,1|2,0,0]=4 3484 B16R2.2257 c1cncc(c1)OCCCC2CCCC2 7a_100000210849_100011713738 [0,0,1,0,0,1|2,0,0]=4 3485 B16R2.2257 c1cncc(c1)OCCNC2CCCC2 2230a_100000754688_100000179811 [0,0,1,0,0,1|1,0,0]=3 3486 B16R2.2257 c1cncc(c1)OCCNC2CCCC2 270004a_100000754688_100000210133 [0,0,1,0,0,1|1,0,0]=3 3487 B16R2.2257 c1cncc(c1)OCCNC2CCOC2 2230a_100000754688_100000731011 [0,0,1,0,0,1|2,0,0]=4 3488 B16R2.2257 c1cncc(c1)OCCNC2CCOC2 270004a_100000754688_100000752484 [0,0,1,0,0,1|2,0,0]=4 3489 B16R2.2257 c1cncc(c1)OCCNC2CCSC2 270004a_100000754688_100000212027 [0,0,1,0,0,1|2,0,0]=4 3490 B16R2.2257 c1cncc(c1)SCCCC2CCCC2 62a_100000210063_100011713738 [0,0,1,0,0,1|2,0,0]=4 3491 B16R2.2257 c1cncc(c1)SCCCC2CCCC2 62a_100011713738_100000210063 [0,0,1,0,0,1|2,0,0]=4 3492 B18R3.12824 c1ccc(cc1)CO[C@H]2CO[C@@H]3[C@H]2CCO3 34a_100015698664_100015291786 [0,0,0,0,0,2|2,0,0]=4 3493 B18R3.12824 c1ccc(cc1)CO[C@H]2CO[C@@H]3[C@H]2CCO3 7a_100015698664_100000211182 [0,0,0,0,0,2|2,0,0]=4