0 B13R2.3 C1=C(CCCC1)c2ccccn2 271570a_100000062251_100011216584 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.3 C1=C(CCCC1)c2ncccn2 271570a_100000062251_100000211032 [0,0,0,0,0,0|2,0,1]=3 2 B13R2.3 C1=C(CCCO1)c2ncccn2 271570a_100010175576_100000211032 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.3 C1=C(CCNC1)c2ccccc2 271570a_100000731432_100000210277 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.3 C1=C(CCNC1)c2ccccn2 271570a_100000731432_100011216584 [0,0,0,0,0,0|2,0,1]=3 5 B13R2.3 C1=C(CCNC1)c2cccnn2 271570a_100000731432_100016991348 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.3 C1=C(CCNC1)c2ccncn2 271570a_100000731432_100000703185 [0,0,0,0,0,0|3,0,1]=4 7 B13R2.3 C1=C(CCNC1)c2cnccn2 271570a_100000731432_100000758340 [0,0,0,0,0,0|3,0,1]=4 8 B13R2.3 C1=C(CCNC1)c2ncccn2 271570a_100000731432_100000211032 [0,0,0,0,0,0|1,0,1]=2 9 B13R2.3 C1=C(CCOC1)c2ccccn2 271570a_100000070234_100011216584 [0,0,0,0,0,0|3,0,1]=4 10 B13R2.3 C1=C(CCOC1)c2ncccn2 271570a_100000070234_100000211032 [0,0,0,0,0,0|2,0,1]=3 11 B13R2.3 C1=C(CCSC1)c2ccccn2 271570a_100010232141_100011216584 [0,0,0,0,0,0|3,0,1]=4 12 B13R2.3 C1=C(CCSC1)c2ncccn2 271570a_100010232141_100000211032 [0,0,0,0,0,0|2,0,1]=3 13 B13R2.3 C1=C(OCCC1)c2ncccn2 271570a_100010177797_100000211032 [0,0,0,0,0,0|3,0,1]=4 14 B13R2.3 C1=CCN(CC1)c2cccnn2 27a_100000698166_100016991348 [0,0,0,0,0,0|3,0,1]=4 15 B13R2.3 C1=CCN(CC1)c2ccncn2 27a_100000698166_100000703185 [0,0,0,0,0,0|3,0,1]=4 16 B13R2.3 C1=CCN(CC1)c2cnccn2 27a_100000698166_100000211759 [0,0,0,0,0,0|3,0,1]=4 17 B13R2.3 C1=CCN(CC1)c2ncccn2 27a_100000698166_100000211032 [0,0,0,0,0,0|1,0,1]=2 18 B13R2.3 c1cc(ncn1)N2CCOCC2 27a_100015191051_100000703185 [0,0,0,0,0,0|3,0,0]=3 19 B13R2.3 c1cc(ncn1)N2CCSCC2 27a_100000737611_100000703185 [0,0,0,0,0,0|3,0,0]=3 20 B13R2.3 c1cnc(cn1)N2CCOCC2 27a_100015191051_100000211759 [0,0,0,0,0,0|3,0,0]=3 21 B13R2.3 c1cnc(cn1)N2CCSCC2 27a_100000737611_100000211759 [0,0,0,0,0,0|3,0,0]=3 22 B13R2.3 c1cnc(nc1)N2CCOCC2 27a_100015191051_100000211032 [0,0,0,0,0,0|1,0,0]=1 23 B13R2.3 c1cnc(nc1)N2CCSCC2 27a_100000737611_100000211032 [0,0,0,0,0,0|1,0,0]=1 24 B13R2.3 c1cnnc(c1)N2CCOCC2 27a_100015191051_100016991348 [0,0,0,0,0,0|3,0,0]=3 25 B13R2.3 c1cnnc(c1)N2CCSCC2 27a_100000737611_100016991348 [0,0,0,0,0,0|3,0,0]=3 26 B14R2.21 Brc1cccc(n1)C2=CCNCC2 271570a_100000731432_100000684672 [0,1,0,0,0,0|2,0,1]=4 27 B14R2.21 CC1=CCCN(C1)c2ncccn2 27a_100000725631_100000211032 [0,1,0,0,0,0|1,0,1]=3 28 B14R2.21 CC1CN(CCO1)c2cccnn2 27a_100000729577_100016991348 [0,1,0,0,0,0|3,0,0]=4 29 B14R2.21 CC1CN(CCO1)c2ccncn2 27a_100000729577_100000703185 [0,1,0,0,0,0|3,0,0]=4 30 B14R2.21 CC1CN(CCO1)c2cnccn2 27a_100000729577_100000211759 [0,1,0,0,0,0|3,0,0]=4 31 B14R2.21 CC1CN(CCO1)c2ncccn2 27a_100000729577_100000211032 [0,1,0,0,0,0|1,0,0]=2 32 B14R2.21 C[C@H]1CCCN(C1)c2cccnn2 27a_100000717927_100016991348 [0,1,0,0,0,0|3,0,0]=4 33 B14R2.21 C[C@H]1CCCN(C1)c2ccncn2 27a_100000717927_100000703185 [0,1,0,0,0,0|3,0,0]=4 34 B14R2.21 C[C@H]1CCCN(C1)c2cnccn2 27a_100000717927_100000211759 [0,1,0,0,0,0|3,0,0]=4 35 B14R2.21 C[C@H]1CCCN(C1)c2ncccn2 27a_100000717927_100000211032 [0,1,0,0,0,0|1,0,0]=2 36 B14R2.21 Cc1cc(ncn1)N2CCOCC2 27a_100015191051_100000744208 [0,1,0,0,0,0|3,0,0]=4 37 B14R2.21 Cc1cc(ncn1)N2CCSCC2 27a_100000737611_100000744208 [0,1,0,0,0,0|3,0,0]=4 38 B14R2.21 Cc1cccc(n1)C2=CCNCC2 271570a_100000731432_100000742759 [0,1,0,0,0,0|2,0,1]=4 39 B14R2.21 Cc1ccnc(c1)C2=CCNCC2 271570a_100000731432_100000750283 [0,1,0,0,0,0|2,0,1]=4 40 B14R2.21 Cc1ccnc(n1)C2=CCCCC2 271570a_100000062251_100011243806 [0,1,0,0,0,0|2,0,1]=4 41 B14R2.21 Cc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100011243806 [0,1,0,0,0,0|1,0,1]=3 42 B14R2.21 Cc1ccnc(n1)C2=CCOCC2 271570a_100000070234_100011243806 [0,1,0,0,0,0|2,0,1]=4 43 B14R2.21 Cc1ccnc(n1)C2=CCSCC2 271570a_100010232141_100011243806 [0,1,0,0,0,0|2,0,1]=4 44 B14R2.21 Cc1ccnc(n1)N2CC=CCC2 27a_100000698166_100000750684 [0,1,0,0,0,0|1,0,1]=3 45 B14R2.21 Cc1ccnc(n1)N2CCOCC2 27a_100015191051_100000750684 [0,1,0,0,0,0|1,0,0]=2 46 B14R2.21 Cc1ccnc(n1)N2CCSCC2 27a_100000737611_100000750684 [0,1,0,0,0,0|1,0,0]=2 47 B14R2.21 Cc1cncc(n1)N2CCOCC2 27a_100015191051_100000754123 [0,1,0,0,0,0|3,0,0]=4 48 B14R2.21 Cc1cncc(n1)N2CCSCC2 27a_100000737611_100000754123 [0,1,0,0,0,0|3,0,0]=4 49 B14R2.21 Cc1cnnc(c1)N2CCOCC2 27a_100015191051_100000070100 [0,1,0,0,0,0|3,0,0]=4 50 B14R2.21 Cc1cnnc(c1)N2CCSCC2 27a_100000737611_100000070100 [0,1,0,0,0,0|3,0,0]=4 51 B14R2.21 Cc1nccc(n1)N2CCOCC2 27a_100015191051_100000749937 [0,1,0,0,0,0|3,0,0]=4 52 B14R2.21 Cc1nccc(n1)N2CCSCC2 27a_100000737611_100000749937 [0,1,0,0,0,0|3,0,0]=4 53 B14R2.21 Clc1ccnc(c1)C2=CCNCC2 271570a_100000731432_100010167805 [0,1,0,0,0,0|2,0,1]=4 54 B14R2.21 Clc1cncc(n1)N2CCOCC2 27a_100015191051_100010892449 [0,1,0,0,0,0|3,0,0]=4 55 B14R2.21 Clc1cncc(n1)N2CCSCC2 27a_100000737611_100010892449 [0,1,0,0,0,0|3,0,0]=4 56 B14R2.21 FC1CCCN(C1)c2cccnn2 27a_100000697950_100016991348 [0,1,0,0,0,0|3,0,0]=4 57 B14R2.21 FC1CCCN(C1)c2ccncn2 27a_100000697950_100000703185 [0,1,0,0,0,0|3,0,0]=4 58 B14R2.21 FC1CCCN(C1)c2cnccn2 27a_100000697950_100000211759 [0,1,0,0,0,0|3,0,0]=4 59 B14R2.21 FC1CCCN(C1)c2ncccn2 27a_100000697950_100000211032 [0,1,0,0,0,0|1,0,0]=2 60 B14R2.21 Fc1cc(ncn1)N2CCOCC2 27a_100015191051_200009880791 [0,1,0,0,0,0|3,0,0]=4 61 B14R2.21 Fc1cc(ncn1)N2CCSCC2 27a_100000737611_200009880791 [0,1,0,0,0,0|3,0,0]=4 62 B14R2.21 Fc1cccc(n1)C2=CCNCC2 271570a_100000731432_100009815982 [0,1,0,0,0,0|2,0,1]=4 63 B14R2.21 Fc1cccc(n1)N2CC=CCC2 27a_100000698166_100009815982 [0,1,0,0,0,0|2,0,1]=4 64 B14R2.21 Fc1cccc(n1)N2CCOCC2 27a_100015191051_100009815982 [0,1,0,0,0,0|2,0,0]=3 65 B14R2.21 Fc1cccc(n1)N2CCSCC2 27a_100000737611_100009815982 [0,1,0,0,0,0|2,0,0]=3 66 B14R2.21 Fc1ccnc(c1)C2=CCNCC2 271570a_100000731432_100009817058 [0,1,0,0,0,0|2,0,1]=4 67 B14R2.21 Fc1ccnc(c1)N2CC=CCC2 27a_100000698166_100000764206 [0,1,0,0,0,0|2,0,1]=4 68 B14R2.21 Fc1ccnc(c1)N2CCOCC2 27a_100015191051_100000764206 [0,1,0,0,0,0|2,0,0]=3 69 B14R2.21 Fc1ccnc(c1)N2CCSCC2 27a_100000737611_100000764206 [0,1,0,0,0,0|2,0,0]=3 70 B14R2.21 Fc1cncc(n1)N2CCOCC2 27a_100015191051_200009863489 [0,1,0,0,0,0|3,0,0]=4 71 B14R2.21 Fc1cncc(n1)N2CCSCC2 27a_100000737611_200009863489 [0,1,0,0,0,0|3,0,0]=4 72 B14R2.21 Nc1cc(ncn1)N2CCOCC2 27a_100015191051_100000701291 [0,1,0,0,0,0|3,0,0]=4 73 B14R2.21 Nc1cc(ncn1)N2CCSCC2 27a_100000737611_100000701291 [0,1,0,0,0,0|3,0,0]=4 74 B14R2.21 Nc1cccc(n1)C2=CCNCC2 271570a_100000731432_100000740741 [0,1,0,0,0,0|2,0,1]=4 75 B14R2.21 Nc1ccnc(c1)C2=CCNCC2 271570a_100000731432_100009814236 [0,1,0,0,0,0|2,0,1]=4 76 B14R2.21 Nc1ccnc(n1)C2=CCCCC2 271570a_100000062251_100000757536 [0,1,0,0,0,0|2,0,1]=4 77 B14R2.21 Nc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100000757536 [0,1,0,0,0,0|1,0,1]=3 78 B14R2.21 Nc1ccnc(n1)C2=CCOCC2 271570a_100000070234_100000757536 [0,1,0,0,0,0|2,0,1]=4 79 B14R2.21 Nc1ccnc(n1)C2=CCSCC2 271570a_100010232141_100000757536 [0,1,0,0,0,0|2,0,1]=4 80 B14R2.21 Nc1ccnc(n1)N2CC=CCC2 27a_100000698166_100000757536 [0,1,0,0,0,0|1,0,1]=3 81 B14R2.21 Nc1ccnc(n1)N2CCOCC2 27a_100015191051_100000757536 [0,1,0,0,0,0|1,0,0]=2 82 B14R2.21 Nc1ccnc(n1)N2CCSCC2 27a_100000737611_100000757536 [0,1,0,0,0,0|1,0,0]=2 83 B14R2.21 Nc1nccc(n1)N2CCOCC2 27a_100015191051_100000055538 [0,1,0,0,0,0|3,0,0]=4 84 B14R2.21 Nc1nccc(n1)N2CCSCC2 27a_100000737611_100000055538 [0,1,0,0,0,0|3,0,0]=4 85 B14R2.21 Nc1ncnc(n1)C2=CCNCC2 271570a_100000731432_100000123831 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.21 Nc1ncnc(n1)N2CC=CCC2 27a_100000698166_100000123831 [0,1,0,0,0,0|2,0,1]=4 87 B14R2.21 Nc1ncnc(n1)N2CCOCC2 27a_100015191051_100000123831 [0,1,0,0,0,0|2,0,0]=3 88 B14R2.21 Nc1ncnc(n1)N2CCSCC2 27a_100000737611_100000123831 [0,1,0,0,0,0|2,0,0]=3 89 B14R2.21 O=C1CN(CCN1)c2cccnn2 27a_100000184651_100016991348 [0,1,0,0,0,0|2,0,1]=4 90 B14R2.21 O=C1CN(CCN1)c2ccncn2 27a_100000184651_100000703185 [0,1,0,0,0,0|2,0,1]=4 91 B14R2.21 O=C1CN(CCN1)c2cnccn2 27a_100000184651_100000211759 [0,1,0,0,0,0|2,0,1]=4 92 B14R2.21 O=C1CN(CCN1)c2ncccn2 27a_100000184651_100000211032 [0,1,0,0,0,0|0,0,1]=2 93 B14R2.21 O=c1nc(cc[nH]1)N2CCOCC2 27a_100015191051_200000134032 [0,1,0,0,0,0|3,0,0]=4 94 B14R2.21 O=c1nc(cc[nH]1)N2CCSCC2 27a_100000737611_200000134032 [0,1,0,0,0,0|3,0,0]=4 95 B14R2.21 OC1CCCN(C1)c2cccnn2 27a_100000211013_100016991348 [0,1,0,0,0,0|3,0,0]=4 96 B14R2.21 OC1CCCN(C1)c2ccncn2 27a_100000211013_100000703185 [0,1,0,0,0,0|3,0,0]=4 97 B14R2.21 OC1CCCN(C1)c2cnccn2 27a_100000211013_100000211759 [0,1,0,0,0,0|3,0,0]=4 98 B14R2.21 OC1CCCN(C1)c2ncccn2 27a_100000211013_100000211032 [0,1,0,0,0,0|1,0,0]=2 99 B14R2.21 Oc1cc(ccn1)N2CCNCC2 271570a_203496583355_100000724660 [0,1,0,0,0,0|3,0,0]=4 100 B14R2.21 Oc1cc(ncn1)N2CCCCC2 271570a_203496583355_100000242479 [0,1,0,0,0,0|3,0,0]=4 101 B14R2.21 Oc1cc(ncn1)N2CCNCC2 271570a_203496583355_100000757499 [0,1,0,0,0,0|2,0,0]=3 102 B14R2.21 Oc1cc(ncn1)N2CCOCC2 271570a_203496583355_100000242505 [0,1,0,0,0,0|3,0,0]=4 103 B14R2.21 Oc1cc(ncn1)N2CCOCC2 27a_100015191051_100000765262 [0,1,0,0,0,0|3,0,0]=4 104 B14R2.21 Oc1cc(ncn1)N2CCSCC2 27a_100000737611_100000765262 [0,1,0,0,0,0|3,0,0]=4 105 B14R2.21 Oc1cccc(c1)C2CCNCC2 271570a_203496583355_100000726733 [0,1,0,0,0,0|3,0,0]=4 106 B14R2.21 Oc1cccc(c1)N2CCCCC2 271570a_203496583355_100159271270 [0,1,0,0,0,0|3,0,0]=4 107 B14R2.21 Oc1cccc(c1)N2CCNCC2 271570a_203496583355_100000729370 [0,1,0,0,0,0|2,0,0]=3 108 B14R2.21 Oc1cccc(c1)N2CCOCC2 271570a_203496583355_100020638979 [0,1,0,0,0,0|3,0,0]=4 109 B14R2.21 Oc1cccc(n1)N2CCCCC2 271570a_203496583355_200011934742 [0,1,0,0,0,0|2,0,0]=3 110 B14R2.21 Oc1cccc(n1)N2CCNCC2 271570a_203496583355_100000741847 [0,1,0,0,0,0|1,0,0]=2 111 B14R2.21 Oc1cccc(n1)N2CCOCC2 271570a_203496583355_100011934752 [0,1,0,0,0,0|2,0,0]=3 112 B14R2.21 Oc1ccnc(c1)C2=CCNCC2 271570a_100000731432_100000762945 [0,1,0,0,0,0|2,0,1]=4 113 B14R2.21 Oc1ccnc(c1)N2CCCCC2 271570a_203496583355_100000100308 [0,1,0,0,0,0|2,0,0]=3 114 B14R2.21 Oc1ccnc(c1)N2CCNCC2 271570a_203496583355_100025705765 [0,1,0,0,0,0|1,0,0]=2 115 B14R2.21 Oc1ccnc(c1)N2CCOCC2 271570a_203496583355_100000732431 [0,1,0,0,0,0|2,0,0]=3 116 B14R2.21 Oc1ccnc(n1)C2=CCCCC2 271570a_100000062251_100011649813 [0,1,0,0,0,0|2,0,1]=4 117 B14R2.21 Oc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100011649813 [0,1,0,0,0,0|1,0,1]=3 118 B14R2.21 Oc1ccnc(n1)C2=CCOCC2 271570a_100000070234_100011649813 [0,1,0,0,0,0|2,0,1]=4 119 B14R2.21 Oc1ccnc(n1)C2=CCSCC2 271570a_100010232141_100011649813 [0,1,0,0,0,0|2,0,1]=4 120 B14R2.21 Oc1ccnc(n1)N2CC=CCC2 27a_100000698166_100011649813 [0,1,0,0,0,0|1,0,1]=3 121 B14R2.21 Oc1ccnc(n1)N2CCNCC2 271570a_203496583355_200020587174 [0,1,0,0,0,0|0,0,0]=1 122 B14R2.21 Oc1ccnc(n1)N2CCOCC2 271570a_203496583355_100000697286 [0,1,0,0,0,0|1,0,0]=2 123 B14R2.21 Oc1ccnc(n1)N2CCOCC2 27a_100015191051_100011649813 [0,1,0,0,0,0|1,0,0]=2 124 B14R2.21 Oc1ccnc(n1)N2CCSCC2 27a_100000737611_100011649813 [0,1,0,0,0,0|1,0,0]=2 125 B14R2.21 Oc1cncc(c1)N2CCNCC2 271570a_203496583355_102495364777 [0,1,0,0,0,0|3,0,0]=4 126 B14R2.21 Oc1cncc(n1)N2CCCCC2 271570a_203496583355_100011209846 [0,1,0,0,0,0|3,0,0]=4 127 B14R2.21 Oc1cncc(n1)N2CCNCC2 271570a_203496583355_200015191129 [0,1,0,0,0,0|2,0,0]=3 128 B14R2.21 Oc1cncc(n1)N2CCOCC2 271570a_203496583355_100000243957 [0,1,0,0,0,0|3,0,0]=4 129 B14R2.21 Oc1nccc(n1)N2CCCCC2 271570a_203496583355_100011649928 [0,1,0,0,0,0|3,0,0]=4 130 B14R2.21 Oc1nccc(n1)N2CCOCC2 271570a_203496583355_100000689013 [0,1,0,0,0,0|3,0,0]=4 131 B14R2.21 [O-][n+]1ccnc(c1)N2CCOCC2 27a_100015191051_100009880115 [0,1,0,0,0,0|3,0,0]=4 132 B14R2.21 [O-][n+]1ccnc(c1)N2CCSCC2 27a_100000737611_100009880115 [0,1,0,0,0,0|3,0,0]=4 133 B14R2.24 Brc1cccnc1C2=CCNCC2 271570a_100000731432_100000696092 [0,1,0,0,0,0|2,0,1]=4 134 B14R2.24 Brc1cccnc1N2CC=CCC2 27a_100000698166_100000696092 [0,1,0,0,0,0|2,0,1]=4 135 B14R2.24 Brc1cccnc1N2CCOCC2 27a_100015191051_100000696092 [0,1,0,0,0,0|2,0,0]=3 136 B14R2.24 Brc1cccnc1N2CCSCC2 27a_100000737611_100000696092 [0,1,0,0,0,0|2,0,0]=3 137 B14R2.24 CC1CCCCN1c2cccnn2 27a_100000211376_100016991348 [0,1,0,0,0,0|3,0,0]=4 138 B14R2.24 CC1CCCCN1c2ccncn2 27a_100000211376_100000703185 [0,1,0,0,0,0|3,0,0]=4 139 B14R2.24 CC1CCCCN1c2cnccn2 27a_100000211376_100000211759 [0,1,0,0,0,0|3,0,0]=4 140 B14R2.24 CC1CCCCN1c2ncccn2 27a_100000211376_100000211032 [0,1,0,0,0,0|1,0,0]=2 141 B14R2.24 C[C@H]1COCCN1c2cccnn2 27a_100009815349_100016991348 [0,1,0,0,0,0|3,0,0]=4 142 B14R2.24 C[C@H]1COCCN1c2ccncn2 27a_100009815349_100000703185 [0,1,0,0,0,0|3,0,0]=4 143 B14R2.24 C[C@H]1COCCN1c2cnccn2 27a_100009815349_100000211759 [0,1,0,0,0,0|3,0,0]=4 144 B14R2.24 C[C@H]1COCCN1c2ncccn2 27a_100009815349_100000211032 [0,1,0,0,0,0|1,0,0]=2 145 B14R2.24 Cc1cccnc1C2=CCNCC2 271570a_100000731432_100000751373 [0,1,0,0,0,0|2,0,1]=4 146 B14R2.24 Cc1ccnnc1N2CCOCC2 27a_100015191051_100000089043 [0,1,0,0,0,0|3,0,0]=4 147 B14R2.24 Cc1ccnnc1N2CCSCC2 27a_100000737611_100000089043 [0,1,0,0,0,0|3,0,0]=4 148 B14R2.24 Cc1cncnc1N2CCOCC2 27a_100015191051_100011998708 [0,1,0,0,0,0|3,0,0]=4 149 B14R2.24 Cc1cncnc1N2CCSCC2 27a_100000737611_100011998708 [0,1,0,0,0,0|3,0,0]=4 150 B14R2.24 Cc1nccnc1N2CCOCC2 27a_100015191051_100011999405 [0,1,0,0,0,0|3,0,0]=4 151 B14R2.24 Cc1nccnc1N2CCSCC2 27a_100000737611_100011999405 [0,1,0,0,0,0|3,0,0]=4 152 B14R2.24 Clc1cccnc1C2=CCNCC2 271570a_100000731432_100011356963 [0,1,0,0,0,0|2,0,1]=4 153 B14R2.24 Fc1cccnc1C2=CCNCC2 271570a_100000731432_100000685392 [0,1,0,0,0,0|2,0,1]=4 154 B14R2.24 Fc1cncnc1N2CCOCC2 27a_100015191051_100000069762 [0,1,0,0,0,0|3,0,0]=4 155 B14R2.24 Fc1cncnc1N2CCSCC2 27a_100000737611_100000069762 [0,1,0,0,0,0|3,0,0]=4 156 B14R2.24 Fc1nccnc1N2CCOCC2 27a_100015191051_200010125657 [0,1,0,0,0,0|3,0,0]=4 157 B14R2.24 Fc1nccnc1N2CCSCC2 27a_100000737611_200010125657 [0,1,0,0,0,0|3,0,0]=4 158 B14R2.24 Nc1cccnc1C2=CCNCC2 271570a_100000731432_100000688686 [0,1,0,0,0,0|2,0,1]=4 159 B14R2.24 Nc1cncnc1N2CCOCC2 27a_100015191051_100000709731 [0,1,0,0,0,0|3,0,0]=4 160 B14R2.24 Nc1cncnc1N2CCSCC2 27a_100000737611_100000709731 [0,1,0,0,0,0|3,0,0]=4 161 B14R2.24 Oc1ccccc1N2CCCCC2 271570a_203496583355_100159312943 [0,1,0,0,0,0|3,0,0]=4 162 B14R2.24 Oc1ccccc1N2CCNCC2 271570a_203496583355_102495324788 [0,1,0,0,0,0|2,0,0]=3 163 B14R2.24 Oc1ccccc1N2CCOCC2 271570a_203496583355_100011821384 [0,1,0,0,0,0|3,0,0]=4 164 B14R2.24 Oc1cccnc1C2=CCNCC2 271570a_100000731432_100000034122 [0,1,0,0,0,0|2,0,1]=4 165 B14R2.24 Oc1cccnc1N2CCCCC2 271570a_203496583355_200103154647 [0,1,0,0,0,0|2,0,0]=3 166 B14R2.24 Oc1cccnc1N2CCNCC2 271570a_203496583355_200000047011 [0,1,0,0,0,0|1,0,0]=2 167 B14R2.24 Oc1cccnc1N2CCOCC2 271570a_203496583355_200011465045 [0,1,0,0,0,0|2,0,0]=3 168 B14R2.24 Oc1nccnc1N2CCNCC2 271570a_203496583355_200020639423 [0,1,0,0,0,0|2,0,0]=3 169 B14R2.68 Brc1ccc(nc1)C2=CCNCC2 271570a_100000731432_100000686858 [0,1,0,0,0,0|2,0,1]=4 170 B14R2.68 Brc1ccc(nc1)N2CC=CCC2 27a_100000698166_100000686858 [0,1,0,0,0,0|2,0,1]=4 171 B14R2.68 Brc1ccc(nc1)N2CCOCC2 27a_100015191051_100000686858 [0,1,0,0,0,0|2,0,0]=3 172 B14R2.68 Brc1ccc(nc1)N2CCSCC2 27a_100000737611_100000686858 [0,1,0,0,0,0|2,0,0]=3 173 B14R2.68 Brc1cnc(cn1)N2CCOCC2 27a_100015191051_100010187541 [0,1,0,0,0,0|3,0,0]=4 174 B14R2.68 Brc1cnc(cn1)N2CCSCC2 27a_100000737611_100010187541 [0,1,0,0,0,0|3,0,0]=4 175 B14R2.68 Brc1cnc(nc1)C2=CCCCC2 271570a_100000062251_100000690281 [0,1,0,0,0,0|2,0,1]=4 176 B14R2.68 Brc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000690281 [0,1,0,0,0,0|1,0,1]=3 177 B14R2.68 Brc1cnc(nc1)C2=CCOCC2 271570a_100000070234_100000690281 [0,1,0,0,0,0|2,0,1]=4 178 B14R2.68 Brc1cnc(nc1)C2=CCSCC2 271570a_100010232141_100000690281 [0,1,0,0,0,0|2,0,1]=4 179 B14R2.68 Brc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000690281 [0,1,0,0,0,0|1,0,1]=3 180 B14R2.68 Brc1cnc(nc1)N2CCOCC2 27a_100015191051_100000690281 [0,1,0,0,0,0|1,0,0]=2 181 B14R2.68 Brc1cnc(nc1)N2CCSCC2 27a_100000737611_100000690281 [0,1,0,0,0,0|1,0,0]=2 182 B14R2.68 C=C1CCN(CC1)c2cccnn2 27a_100000752442_100016991348 [0,1,0,0,0,0|3,0,0]=4 183 B14R2.68 C=C1CCN(CC1)c2ccncn2 27a_100000752442_100000703185 [0,1,0,0,0,0|3,0,0]=4 184 B14R2.68 C=C1CCN(CC1)c2cnccn2 27a_100000752442_100000211759 [0,1,0,0,0,0|3,0,0]=4 185 B14R2.68 C=C1CCN(CC1)c2ncccn2 27a_100000752442_100000211032 [0,1,0,0,0,0|1,0,0]=2 186 B14R2.68 CC1=CCN(CC1)c2ncccn2 27a_100000693516_100000211032 [0,1,0,0,0,0|1,0,1]=3 187 B14R2.68 CC1CC=C(CC1)c2ncccn2 271570a_100010240233_100000211032 [0,1,0,0,0,0|2,0,1]=4 188 B14R2.68 CC1CCN(CC1)c2cccnn2 27a_100000188429_100016991348 [0,1,0,0,0,0|3,0,0]=4 189 B14R2.68 CC1CCN(CC1)c2ccncn2 27a_100000188429_100000703185 [0,1,0,0,0,0|3,0,0]=4 190 B14R2.68 CC1CCN(CC1)c2cnccn2 27a_100000188429_100000211759 [0,1,0,0,0,0|3,0,0]=4 191 B14R2.68 CC1CCN(CC1)c2ncccn2 27a_100000188429_100000211032 [0,1,0,0,0,0|1,0,0]=2 192 B14R2.68 CN1CC=C(CC1)c2ncccn2 2230a_200160996789_200000210301 [0,1,0,0,0,0|1,0,1]=3 193 B14R2.68 CN1CC=C(CC1)c2ncccn2 269982a_200160996789_200000210301 [0,1,0,0,0,0|1,0,1]=3 194 B14R2.68 CN1CCC(CC1)c2ccccc2 2230a_100000736203_200000210301 [0,1,0,0,0,0|3,0,0]=4 195 B14R2.68 CN1CCC(CC1)c2ccccc2 269982a_100000736203_200000210301 [0,1,0,0,0,0|3,0,0]=4 196 B14R2.68 CN1CCC(CC1)c2ccccc2 34a_100000736203_200000210301 [0,1,0,0,0,0|3,0,0]=4 197 B14R2.68 CN1CCC(CC1)c2ncccn2 2230a_100025774034_200000210301 [0,1,0,0,0,0|1,0,0]=2 198 B14R2.68 CN1CCC(CC1)c2ncccn2 269982a_100025774034_200000210301 [0,1,0,0,0,0|1,0,0]=2 199 B14R2.68 CN1CCN(CC1)c2ccccc2 2230a_200000209977_200000210301 [0,1,0,0,0,0|2,0,0]=3 200 B14R2.68 CN1CCN(CC1)c2ccccc2 269982a_200000209977_200000210301 [0,1,0,0,0,0|2,0,0]=3 201 B14R2.68 CN1CCN(CC1)c2ccccn2 2230a_100000736569_200000210301 [0,1,0,0,0,0|1,0,0]=2 202 B14R2.68 CN1CCN(CC1)c2ccccn2 269982a_100000736569_200000210301 [0,1,0,0,0,0|1,0,0]=2 203 B14R2.68 CN1CCN(CC1)c2cccnc2 2230a_100011360377_200000210301 [0,1,0,0,0,0|3,0,0]=4 204 B14R2.68 CN1CCN(CC1)c2cccnc2 269982a_100011360377_200000210301 [0,1,0,0,0,0|3,0,0]=4 205 B14R2.68 CN1CCN(CC1)c2cccnn2 2230a_100000749033_200000210301 [0,1,0,0,0,0|2,0,0]=3 206 B14R2.68 CN1CCN(CC1)c2cccnn2 269982a_100000749033_200000210301 [0,1,0,0,0,0|2,0,0]=3 207 B14R2.68 CN1CCN(CC1)c2cccnn2 27a_100000188432_100016991348 [0,1,0,0,0,0|2,0,0]=3 208 B14R2.68 CN1CCN(CC1)c2ccncc2 2230a_100000212232_200000210301 [0,1,0,0,0,0|3,0,0]=4 209 B14R2.68 CN1CCN(CC1)c2ccncc2 269982a_100000212232_200000210301 [0,1,0,0,0,0|3,0,0]=4 210 B14R2.68 CN1CCN(CC1)c2ccncn2 2230a_100016991319_200000210301 [0,1,0,0,0,0|2,0,0]=3 211 B14R2.68 CN1CCN(CC1)c2ccncn2 269982a_100016991319_200000210301 [0,1,0,0,0,0|2,0,0]=3 212 B14R2.68 CN1CCN(CC1)c2ccncn2 27a_100000188432_100000703185 [0,1,0,0,0,0|2,0,0]=3 213 B14R2.68 CN1CCN(CC1)c2cnccn2 2230a_100000243169_200000210301 [0,1,0,0,0,0|2,0,0]=3 214 B14R2.68 CN1CCN(CC1)c2cnccn2 269982a_100000243169_200000210301 [0,1,0,0,0,0|2,0,0]=3 215 B14R2.68 CN1CCN(CC1)c2cnccn2 27a_100000188432_100000211759 [0,1,0,0,0,0|2,0,0]=3 216 B14R2.68 CN1CCN(CC1)c2ncccn2 2230a_100000211082_200000210301 [0,1,0,0,0,0|0,0,0]=1 217 B14R2.68 CN1CCN(CC1)c2ncccn2 269982a_100000211082_200000210301 [0,1,0,0,0,0|0,0,0]=1 218 B14R2.68 CN1CCN(CC1)c2ncccn2 27a_100000188432_100000211032 [0,1,0,0,0,0|0,0,0]=1 219 B14R2.68 CN1CCN(CC1)c2nccnn2 2230a_200000102074_200000210301 [0,1,0,0,0,0|1,0,0]=2 220 B14R2.68 CN1CCN(CC1)c2nccnn2 269982a_200000102074_200000210301 [0,1,0,0,0,0|1,0,0]=2 221 B14R2.68 CN1CCN(CC1)c2ncncn2 2230a_200000041971_200000210301 [0,1,0,0,0,0|1,0,0]=2 222 B14R2.68 CN1CCN(CC1)c2ncncn2 269982a_200000041971_200000210301 [0,1,0,0,0,0|1,0,0]=2 223 B14R2.68 Cc1ccc(nc1)C2=CCNCC2 271570a_100000731432_100000754016 [0,1,0,0,0,0|2,0,1]=4 224 B14R2.68 Cc1ccc(nn1)N2CCOCC2 27a_100015191051_100000744512 [0,1,0,0,0,0|3,0,0]=4 225 B14R2.68 Cc1ccc(nn1)N2CCSCC2 27a_100000737611_100000744512 [0,1,0,0,0,0|3,0,0]=4 226 B14R2.68 Cc1cnc(cn1)N2CCOCC2 27a_100015191051_100000074397 [0,1,0,0,0,0|3,0,0]=4 227 B14R2.68 Cc1cnc(cn1)N2CCSCC2 27a_100000737611_100000074397 [0,1,0,0,0,0|3,0,0]=4 228 B14R2.68 Cc1cnc(nc1)C2=CCCCC2 271570a_100000062251_100011825175 [0,1,0,0,0,0|2,0,1]=4 229 B14R2.68 Cc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100011825175 [0,1,0,0,0,0|1,0,1]=3 230 B14R2.68 Cc1cnc(nc1)C2=CCOCC2 271570a_100000070234_100011825175 [0,1,0,0,0,0|2,0,1]=4 231 B14R2.68 Cc1cnc(nc1)C2=CCSCC2 271570a_100010232141_100011825175 [0,1,0,0,0,0|2,0,1]=4 232 B14R2.68 Cc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000061069 [0,1,0,0,0,0|1,0,1]=3 233 B14R2.68 Cc1cnc(nc1)N2CCOCC2 27a_100015191051_100000061069 [0,1,0,0,0,0|1,0,0]=2 234 B14R2.68 Cc1cnc(nc1)N2CCSCC2 27a_100000737611_100000061069 [0,1,0,0,0,0|1,0,0]=2 235 B14R2.68 Clc1ccc(nc1)C2=CCNCC2 271570a_100000731432_100011356976 [0,1,0,0,0,0|2,0,1]=4 236 B14R2.68 Clc1cnc(nc1)C2=CCCCC2 271570a_100000062251_100011356929 [0,1,0,0,0,0|2,0,1]=4 237 B14R2.68 Clc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100011356929 [0,1,0,0,0,0|1,0,1]=3 238 B14R2.68 Clc1cnc(nc1)C2=CCOCC2 271570a_100000070234_100011356929 [0,1,0,0,0,0|2,0,1]=4 239 B14R2.68 Clc1cnc(nc1)C2=CCSCC2 271570a_100010232141_100011356929 [0,1,0,0,0,0|2,0,1]=4 240 B14R2.68 Clc1cnc(nc1)N2CC=CCC2 27a_100000698166_100011356929 [0,1,0,0,0,0|1,0,1]=3 241 B14R2.68 Clc1cnc(nc1)N2CCOCC2 27a_100015191051_100011356929 [0,1,0,0,0,0|1,0,0]=2 242 B14R2.68 Clc1cnc(nc1)N2CCSCC2 27a_100000737611_100011356929 [0,1,0,0,0,0|1,0,0]=2 243 B14R2.68 FC1CCN(CC1)c2cccnn2 27a_100015193889_100016991348 [0,1,0,0,0,0|3,0,0]=4 244 B14R2.68 FC1CCN(CC1)c2ccncn2 27a_100015193889_100000703185 [0,1,0,0,0,0|3,0,0]=4 245 B14R2.68 FC1CCN(CC1)c2cnccn2 27a_100015193889_100000211759 [0,1,0,0,0,0|3,0,0]=4 246 B14R2.68 FC1CCN(CC1)c2ncccn2 27a_100015193889_100000211032 [0,1,0,0,0,0|1,0,0]=2 247 B14R2.68 Fc1ccc(nc1)C2=CCNCC2 271570a_100000731432_100000744514 [0,1,0,0,0,0|2,0,1]=4 248 B14R2.68 Fc1cnc(cn1)N2CCOCC2 27a_100015191051_100009856528 [0,1,0,0,0,0|3,0,0]=4 249 B14R2.68 Fc1cnc(cn1)N2CCSCC2 27a_100000737611_100009856528 [0,1,0,0,0,0|3,0,0]=4 250 B14R2.68 Fc1cnc(nc1)C2=CCCCC2 271570a_100000062251_100000685220 [0,1,0,0,0,0|2,0,1]=4 251 B14R2.68 Fc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000685220 [0,1,0,0,0,0|1,0,1]=3 252 B14R2.68 Fc1cnc(nc1)C2=CCOCC2 271570a_100000070234_100000685220 [0,1,0,0,0,0|2,0,1]=4 253 B14R2.68 Fc1cnc(nc1)C2=CCSCC2 271570a_100010232141_100000685220 [0,1,0,0,0,0|2,0,1]=4 254 B14R2.68 Fc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000685220 [0,1,0,0,0,0|1,0,1]=3 255 B14R2.68 Fc1cnc(nc1)N2CCOCC2 27a_100015191051_100000685220 [0,1,0,0,0,0|1,0,0]=2 256 B14R2.68 Fc1cnc(nc1)N2CCSCC2 27a_100000737611_100000685220 [0,1,0,0,0,0|1,0,0]=2 257 B14R2.68 Nc1ccc(nc1)C2=CCNCC2 271570a_100000731432_100000744251 [0,1,0,0,0,0|2,0,1]=4 258 B14R2.68 Nc1cnc(nc1)C2=CCCCC2 271570a_100000062251_100000068403 [0,1,0,0,0,0|2,0,1]=4 259 B14R2.68 Nc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000068403 [0,1,0,0,0,0|1,0,1]=3 260 B14R2.68 Nc1cnc(nc1)C2=CCOCC2 271570a_100000070234_100000068403 [0,1,0,0,0,0|2,0,1]=4 261 B14R2.68 Nc1cnc(nc1)C2=CCSCC2 271570a_100010232141_100000068403 [0,1,0,0,0,0|2,0,1]=4 262 B14R2.68 O=S1CCN(CC1)c2cccnn2 27a_100000752083_100016991348 [0,1,0,0,0,0|3,0,0]=4 263 B14R2.68 O=S1CCN(CC1)c2ccncn2 27a_100000752083_100000703185 [0,1,0,0,0,0|3,0,0]=4 264 B14R2.68 O=S1CCN(CC1)c2cnccn2 27a_100000752083_100000211759 [0,1,0,0,0,0|3,0,0]=4 265 B14R2.68 O=S1CCN(CC1)c2ncccn2 27a_100000752083_100000211032 [0,1,0,0,0,0|1,0,0]=2 266 B14R2.68 OC1CC=C(CC1)c2ncccn2 271570a_100010254553_100000211032 [0,1,0,0,0,0|2,0,1]=4 267 B14R2.68 OC1CCN(CC1)c2cccnn2 27a_100025773856_100016991348 [0,1,0,0,0,0|3,0,0]=4 268 B14R2.68 OC1CCN(CC1)c2ccncn2 27a_100025773856_100000703185 [0,1,0,0,0,0|3,0,0]=4 269 B14R2.68 OC1CCN(CC1)c2cnccn2 27a_100025773856_100000211759 [0,1,0,0,0,0|3,0,0]=4 270 B14R2.68 OC1CCN(CC1)c2ncccn2 27a_100025773856_100000211032 [0,1,0,0,0,0|1,0,0]=2 271 B14R2.68 Oc1ccc(cc1)C2CCNCC2 271570a_203496583355_100000727425 [0,1,0,0,0,0|3,0,0]=4 272 B14R2.68 Oc1ccc(cc1)N2CCCCC2 271570a_203496583355_100011821443 [0,1,0,0,0,0|3,0,0]=4 273 B14R2.68 Oc1ccc(cc1)N2CCNCC2 271570a_203496583355_100011236372 [0,1,0,0,0,0|2,0,0]=3 274 B14R2.68 Oc1ccc(cc1)N2CCOCC2 271570a_203496583355_100011821381 [0,1,0,0,0,0|3,0,0]=4 275 B14R2.68 Oc1ccc(nc1)C2=CCNCC2 271570a_100000731432_100000685995 [0,1,0,0,0,0|2,0,1]=4 276 B14R2.68 Oc1ccc(nc1)C2CCOCC2 271570a_203496583355_200010157694 [0,1,0,0,0,0|3,0,0]=4 277 B14R2.68 Oc1ccc(nc1)N2CCCCC2 271570a_203496583355_200102616235 [0,1,0,0,0,0|2,0,0]=3 278 B14R2.68 Oc1ccc(nc1)N2CCNCC2 271570a_203496583355_100000739387 [0,1,0,0,0,0|1,0,0]=2 279 B14R2.68 Oc1ccc(nc1)N2CCOCC2 271570a_203496583355_100011465330 [0,1,0,0,0,0|2,0,0]=3 280 B14R2.68 Oc1ccc(nn1)N2CCCCC2 271570a_203496583355_100000209946 [0,1,0,0,0,0|3,0,0]=4 281 B14R2.68 Oc1ccc(nn1)N2CCNCC2 271570a_203496583355_100000736700 [0,1,0,0,0,0|2,0,0]=3 282 B14R2.68 Oc1ccc(nn1)N2CCOCC2 271570a_203496583355_100000187598 [0,1,0,0,0,0|3,0,0]=4 283 B14R2.68 Oc1ccc(nn1)N2CCSCC2 271570a_203496583355_100011264209 [0,1,0,0,0,0|3,0,0]=4 284 B14R2.68 Oc1cnc(cn1)N2CCCCC2 271570a_203496583355_200012356706 [0,1,0,0,0,0|3,0,0]=4 285 B14R2.68 Oc1cnc(cn1)N2CCOCC2 271570a_203496583355_100012356705 [0,1,0,0,0,0|3,0,0]=4 286 B14R2.68 Oc1cnc(nc1)C2=CCCCC2 271570a_100000062251_100000730009 [0,1,0,0,0,0|2,0,1]=4 287 B14R2.68 Oc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000730009 [0,1,0,0,0,0|1,0,1]=3 288 B14R2.68 Oc1cnc(nc1)C2=CCOCC2 271570a_100000070234_100000730009 [0,1,0,0,0,0|2,0,1]=4 289 B14R2.68 Oc1cnc(nc1)C2=CCSCC2 271570a_100010232141_100000730009 [0,1,0,0,0,0|2,0,1]=4 290 B14R2.68 Oc1cnc(nc1)N2CCCCC2 271570a_203496583355_100011934054 [0,1,0,0,0,0|1,0,0]=2 291 B14R2.68 Oc1cnc(nc1)N2CCNCC2 271570a_203496583355_100000739398 [0,1,0,0,0,0|0,0,0]=1 292 B14R2.68 Oc1cnc(nc1)N2CCOCC2 271570a_203496583355_100011397833 [0,1,0,0,0,0|1,0,0]=2 293 B14R2.68 Oc1cnc(nc1)N2CCSCC2 271570a_203496583355_100011939189 [0,1,0,0,0,0|1,0,0]=2 294 B14R2.68 [13CH3]N1CC=C(CC1)c2ncccn2 2230a_200160996789_200025704644 [0,1,0,0,0,0|1,0,1]=3 295 B14R2.68 [13CH3]N1CC=C(CC1)c2ncccn2 269982a_200160996789_200025704644 [0,1,0,0,0,0|1,0,1]=3 296 B14R2.68 [13CH3]N1CCC(CC1)c2ccccc2 2230a_100000736203_200025704644 [0,1,0,0,0,0|3,0,0]=4 297 B14R2.68 [13CH3]N1CCC(CC1)c2ccccc2 269982a_100000736203_200025704644 [0,1,0,0,0,0|3,0,0]=4 298 B14R2.68 [13CH3]N1CCC(CC1)c2ccccc2 34a_100000736203_200025704644 [0,1,0,0,0,0|3,0,0]=4 299 B14R2.68 [13CH3]N1CCC(CC1)c2ncccn2 2230a_100025774034_200025704644 [0,1,0,0,0,0|1,0,0]=2 300 B14R2.68 [13CH3]N1CCC(CC1)c2ncccn2 269982a_100025774034_200025704644 [0,1,0,0,0,0|1,0,0]=2 301 B14R2.68 [13CH3]N1CCN(CC1)c2ccccc2 2230a_200000209977_200025704644 [0,1,0,0,0,0|2,0,0]=3 302 B14R2.68 [13CH3]N1CCN(CC1)c2ccccc2 269982a_200000209977_200025704644 [0,1,0,0,0,0|2,0,0]=3 303 B14R2.68 [13CH3]N1CCN(CC1)c2ccccn2 2230a_100000736569_200025704644 [0,1,0,0,0,0|1,0,0]=2 304 B14R2.68 [13CH3]N1CCN(CC1)c2ccccn2 269982a_100000736569_200025704644 [0,1,0,0,0,0|1,0,0]=2 305 B14R2.68 [13CH3]N1CCN(CC1)c2cccnc2 2230a_100011360377_200025704644 [0,1,0,0,0,0|3,0,0]=4 306 B14R2.68 [13CH3]N1CCN(CC1)c2cccnc2 269982a_100011360377_200025704644 [0,1,0,0,0,0|3,0,0]=4 307 B14R2.68 [13CH3]N1CCN(CC1)c2cccnn2 2230a_100000749033_200025704644 [0,1,0,0,0,0|2,0,0]=3 308 B14R2.68 [13CH3]N1CCN(CC1)c2cccnn2 269982a_100000749033_200025704644 [0,1,0,0,0,0|2,0,0]=3 309 B14R2.68 [13CH3]N1CCN(CC1)c2ccncc2 2230a_100000212232_200025704644 [0,1,0,0,0,0|3,0,0]=4 310 B14R2.68 [13CH3]N1CCN(CC1)c2ccncc2 269982a_100000212232_200025704644 [0,1,0,0,0,0|3,0,0]=4 311 B14R2.68 [13CH3]N1CCN(CC1)c2ccncn2 2230a_100016991319_200025704644 [0,1,0,0,0,0|2,0,0]=3 312 B14R2.68 [13CH3]N1CCN(CC1)c2ccncn2 269982a_100016991319_200025704644 [0,1,0,0,0,0|2,0,0]=3 313 B14R2.68 [13CH3]N1CCN(CC1)c2cnccn2 2230a_100000243169_200025704644 [0,1,0,0,0,0|2,0,0]=3 314 B14R2.68 [13CH3]N1CCN(CC1)c2cnccn2 269982a_100000243169_200025704644 [0,1,0,0,0,0|2,0,0]=3 315 B14R2.68 [13CH3]N1CCN(CC1)c2ncccn2 2230a_100000211082_200025704644 [0,1,0,0,0,0|0,0,0]=1 316 B14R2.68 [13CH3]N1CCN(CC1)c2ncccn2 269982a_100000211082_200025704644 [0,1,0,0,0,0|0,0,0]=1 317 B14R2.68 [13CH3]N1CCN(CC1)c2nccnn2 2230a_200000102074_200025704644 [0,1,0,0,0,0|1,0,0]=2 318 B14R2.68 [13CH3]N1CCN(CC1)c2nccnn2 269982a_200000102074_200025704644 [0,1,0,0,0,0|1,0,0]=2 319 B14R2.68 [13CH3]N1CCN(CC1)c2ncncn2 2230a_200000041971_200025704644 [0,1,0,0,0,0|1,0,0]=2 320 B14R2.68 [13CH3]N1CCN(CC1)c2ncncn2 269982a_200000041971_200025704644 [0,1,0,0,0,0|1,0,0]=2 321 B12R1.3 C#CCN(CC)c1ncccn1 27a_100000744766_100000211032 [0,0,1,0,0,0|1,0,1]=3 322 B12R1.3 CCCN(CC)c1ccccc1 2230a_100000210013_100000210303 [0,0,1,0,0,0|3,0,0]=4 323 B12R1.3 CCCN(CC)c1ccccc1 2230a_200011218496_100000210202 [0,0,1,0,0,0|3,0,0]=4 324 B12R1.3 CCCN(CC)c1ccccc1 269982a_100000210013_100000210303 [0,0,1,0,0,0|3,0,0]=4 325 B12R1.3 CCCN(CC)c1ccccc1 269982a_200011218496_100000204670 [0,0,1,0,0,0|3,0,0]=4 326 B12R1.3 CCCN(CC)c1ccccc1 34a_100000210013_100000210303 [0,0,1,0,0,0|3,0,0]=4 327 B12R1.3 CCCN(CC)c1ccccc1 34a_200011218496_100000210202 [0,0,1,0,0,0|3,0,0]=4 328 B12R1.3 CCCN(CC)c1cccnn1 27a_100000226822_100016991348 [0,0,1,0,0,0|3,0,0]=4 329 B12R1.3 CCCN(CC)c1ccncn1 27a_100000226822_100000703185 [0,0,1,0,0,0|3,0,0]=4 330 B12R1.3 CCCN(CC)c1cnccn1 27a_100000226822_100000211759 [0,0,1,0,0,0|3,0,0]=4 331 B12R1.3 CCCN(CC)c1ncccn1 27a_100000226822_100000211032 [0,0,1,0,0,0|1,0,0]=2 332 B12R1.3 CCN(CCF)c1ccccc1 2230a_100000210013_100011217306 [0,0,1,0,0,0|3,0,0]=4 333 B12R1.3 CCN(CCF)c1ccccc1 269982a_100000210013_100011217306 [0,0,1,0,0,0|3,0,0]=4 334 B12R1.3 CCN(CCF)c1ccccc1 34a_100000210013_100011217306 [0,0,1,0,0,0|3,0,0]=4 335 B12R1.3 CCN(CCO)c1ccccc1 2230a_100000210013_100000211926 [0,0,1,0,0,0|3,0,0]=4 336 B12R1.3 CCN(CCO)c1ccccc1 2230a_100000211345_100000210202 [0,0,1,0,0,0|3,0,0]=4 337 B12R1.3 CCN(CCO)c1ccccc1 269982a_100000210013_100000211926 [0,0,1,0,0,0|3,0,0]=4 338 B12R1.3 CCN(CCO)c1ccccc1 269982a_100000211345_100000204670 [0,0,1,0,0,0|3,0,0]=4 339 B12R1.3 CCN(CCO)c1ccccc1 34a_100000210013_100000211926 [0,0,1,0,0,0|3,0,0]=4 340 B12R1.3 CCN(CCO)c1ccccc1 34a_100000211345_100000210202 [0,0,1,0,0,0|3,0,0]=4 341 B12R1.3 CCN(CCO)c1cccnn1 27a_100000210973_100016991348 [0,0,1,0,0,0|3,0,0]=4 342 B12R1.3 CCN(CCO)c1ccncn1 27a_100000210973_100000703185 [0,0,1,0,0,0|3,0,0]=4 343 B12R1.3 CCN(CCO)c1cnccn1 27a_100000210973_100000211759 [0,0,1,0,0,0|3,0,0]=4 344 B12R1.3 CCN(CCO)c1ncccn1 27a_100000210973_100000211032 [0,0,1,0,0,0|1,0,0]=2 345 B12R1.3 CCNC(CC)c1ncccn1 269862a_100015525214_200011350823 [0,0,1,0,0,0|3,0,0]=4 346 B12R1.3 CCNC(CC)c1ncccn1 270004a_100015525214_200011350823 [0,0,1,0,0,0|3,0,0]=4 347 B12R1.8 C#CCCCNc1ncccn1 27a_100000718082_100000211032 [0,0,1,0,0,0|1,0,2]=4 348 B12R1.8 C=CCCCNc1ncccn1 27a_100000700776_100000211032 [0,0,1,0,0,0|1,0,2]=4 349 B12R1.8 CC/C=C\CSc1ncccn1 62a_100000211032_100103147603 [0,0,1,0,0,0|2,0,1]=4 350 B12R1.8 CC/C=C\CSc1ncccn1 62a_100103147603_100000211032 [0,0,1,0,0,0|2,0,1]=4 351 B12R1.8 CCC#CCSc1ncccn1 62a_100000211032_100009813939 [0,0,1,0,0,0|2,0,1]=4 352 B12R1.8 CCC#CCSc1ncccn1 62a_100009813939_100000211032 [0,0,1,0,0,0|2,0,1]=4 353 B12R1.8 CCCC=NNc1ncccn1 4a_100000736892_100000185831 [0,0,1,0,0,0|2,0,1]=4 354 B12R1.8 CCCCC=Cc1ncccn1 271570a_100016275911_100000211032 [0,0,1,0,0,0|2,0,1]=4 355 B12R1.8 CCCCCNc1ccccc1 34a_100000106764_100000718602 [0,0,1,0,0,0|3,0,0]=4 356 B12R1.8 CCCCCNc1cccnn1 27a_100000209983_100016991348 [0,0,1,0,0,0|3,0,0]=4 357 B12R1.8 CCCCCNc1ccncn1 27a_100000209983_100000703185 [0,0,1,0,0,0|3,0,0]=4 358 B12R1.8 CCCCCNc1cnccn1 27a_100000209983_100000211759 [0,0,1,0,0,0|3,0,0]=4 359 B12R1.8 CCCCCNc1ncccn1 27a_100000209983_100000211032 [0,0,1,0,0,0|1,0,0]=2 360 B12R1.8 CCCCCSc1ccccn1 62a_100000210326_100011216584 [0,0,1,0,0,0|3,0,0]=4 361 B12R1.8 CCCCCSc1ccccn1 62a_100011216584_100000210326 [0,0,1,0,0,0|3,0,0]=4 362 B12R1.8 CCCCCSc1ncccn1 62a_100000210326_100000211032 [0,0,1,0,0,0|2,0,0]=3 363 B12R1.8 CCCCCSc1ncccn1 62a_100000211032_100000210326 [0,0,1,0,0,0|2,0,0]=3 364 B12R1.8 CCCCNCc1ncccn1 2230a_100000102301_100000703007 [0,0,1,0,0,0|3,0,0]=4 365 B12R1.8 CCCCNCc1ncccn1 270004a_100000102301_100011532527 [0,0,1,0,0,0|3,0,0]=4 366 B12R1.8 CCCCNCc1ncccn1 7a_106832991798_100000703007 [0,0,1,0,0,0|3,0,0]=4 367 B12R1.8 CCCCOCc1ncccn1 34a_100000210227_100000703007 [0,0,1,0,0,0|3,0,0]=4 368 B12R1.8 CCCCOCc1ncccn1 7a_100000210227_100000703007 [0,0,1,0,0,0|3,0,0]=4 369 B12R1.8 CCCCSCc1ncccn1 62a_100000210211_100000703007 [0,0,1,0,0,0|3,0,0]=4 370 B12R1.8 CCCCSCc1ncccn1 62a_100000703007_100000210210 [0,0,1,0,0,0|3,0,0]=4 371 B12R1.8 CCNCCCc1ccccc1 2230a_100000211184_100000210202 [0,0,1,0,0,0|3,0,0]=4 372 B12R1.8 CCNCCCc1ccccc1 2230a_100015525214_100000211621 [0,0,1,0,0,0|3,0,0]=4 373 B12R1.8 CCNCCCc1ccccc1 34a_100000211184_100000210202 [0,0,1,0,0,0|3,0,0]=4 374 B12R1.8 CCNCCOc1ccccc1 2230a_100000174943_100000210202 [0,0,1,0,0,0|3,0,0]=4 375 B12R1.8 CCNCCOc1ccccc1 2230a_100015525214_100000184471 [0,0,1,0,0,0|3,0,0]=4 376 B12R1.8 CCNCCOc1ccccc1 270004a_100015525214_100000758736 [0,0,1,0,0,0|3,0,0]=4 377 B12R1.8 CCNCCOc1ccccc1 34a_100000174943_100000210202 [0,0,1,0,0,0|3,0,0]=4 378 B12R1.8 CCNCCOc1ccccn1 2230a_106741647558_100000210202 [0,0,1,0,0,0|2,0,0]=3 379 B12R1.8 CCNCCSc1ccccc1 2230a_100000189519_100000210202 [0,0,1,0,0,0|3,0,0]=4 380 B12R1.8 CCNCCSc1ccccc1 2230a_100015525214_100000246102 [0,0,1,0,0,0|3,0,0]=4 381 B12R1.8 CCOCCCc1ccccn1 34a_100011215068_100000210202 [0,0,1,0,0,0|3,0,0]=4 382 B12R1.8 CCOCCNc1ccccc1 34a_100000106764_100000210147 [0,0,1,0,0,0|3,0,0]=4 383 B12R1.8 CCOCCNc1ccccc1 34a_100000211345_100000210202 [0,0,1,0,0,0|3,0,0]=4 384 B12R1.8 CCOCCNc1cccnn1 27a_100011200944_100016991348 [0,0,1,0,0,0|3,0,0]=4 385 B12R1.8 CCOCCNc1ccncn1 27a_100011200944_100000703185 [0,0,1,0,0,0|3,0,0]=4 386 B12R1.8 CCOCCNc1cnccn1 27a_100011200944_100000211759 [0,0,1,0,0,0|3,0,0]=4 387 B12R1.8 CCOCCNc1ncccn1 27a_100011200944_100000211032 [0,0,1,0,0,0|1,0,0]=2 388 B12R1.8 CCOCCSc1ccccn1 62a_100000210147_100011216584 [0,0,1,0,0,0|3,0,0]=4 389 B12R1.8 CCOCCSc1ccccn1 62a_100011216584_100011215890 [0,0,1,0,0,0|3,0,0]=4 390 B12R1.8 CCOCCSc1ccccn1 7a_100000156319_100000210202 [0,0,1,0,0,0|3,0,0]=4 391 B12R1.8 CCOCCSc1ncccn1 62a_100000210147_100000211032 [0,0,1,0,0,0|2,0,0]=3 392 B12R1.8 CCOCCSc1ncccn1 62a_100000211032_100011215890 [0,0,1,0,0,0|2,0,0]=3 393 B12R1.8 CCOCSCc1ncccn1 62a_100000703007_100000739092 [0,0,1,0,0,0|3,0,0]=4 394 B12R1.8 CCOCSCc1ncccn1 62a_100000739092_100000703007 [0,0,1,0,0,0|3,0,0]=4 395 B12R1.8 CCSCCNc1ccccc1 34a_100000106764_100000757381 [0,0,1,0,0,0|3,0,0]=4 396 B12R1.8 CCSCCNc1cccnn1 27a_100000106463_100016991348 [0,0,1,0,0,0|3,0,0]=4 397 B12R1.8 CCSCCNc1ccncn1 27a_100000106463_100000703185 [0,0,1,0,0,0|3,0,0]=4 398 B12R1.8 CCSCCNc1cnccn1 27a_100000106463_100000211759 [0,0,1,0,0,0|3,0,0]=4 399 B12R1.8 CCSCCNc1ncccn1 27a_100000106463_100000211032 [0,0,1,0,0,0|1,0,0]=2 400 B12R1.8 CCSCCSc1ccccn1 62a_100000757381_100011216584 [0,0,1,0,0,0|3,0,0]=4 401 B12R1.8 CCSCCSc1ccccn1 62a_100011216584_100000757381 [0,0,1,0,0,0|3,0,0]=4 402 B12R1.8 CCSCCSc1ncccn1 62a_100000211032_100000757381 [0,0,1,0,0,0|2,0,0]=3 403 B12R1.8 CCSCCSc1ncccn1 62a_100000757381_100000211032 [0,0,1,0,0,0|2,0,0]=3 404 B12R1.8 COCCCNc1ncccn1 27a_100150723488_100000211032 [0,0,1,0,0,0|2,0,0]=3 405 B12R1.8 COCCCSc1ncccn1 62a_100000211032_100000709357 [0,0,1,0,0,0|3,0,0]=4 406 B12R1.8 COCCCSc1ncccn1 62a_100000709357_100000211032 [0,0,1,0,0,0|3,0,0]=4 407 B12R1.8 CSCCCNc1ncccn1 27a_100000749238_100000211032 [0,0,1,0,0,0|2,0,0]=3 408 B12R1.8 FCCCCSc1ncccn1 62a_100000211032_100000729493 [0,0,1,0,0,0|3,0,0]=4 409 B12R1.8 FCCCCSc1ncccn1 62a_100000729493_100000211032 [0,0,1,0,0,0|3,0,0]=4 410 B12R1.8 OCCCCNc1ncccn1 27a_100000750430_100000211032 [0,0,1,0,0,0|2,0,0]=3 411 B12R1.8 OCCCCSc1ncccn1 62a_100000210776_100000211032 [0,0,1,0,0,0|3,0,0]=4 412 B12R1.8 OCCCCSc1ncccn1 62a_100000211032_100000210776 [0,0,1,0,0,0|3,0,0]=4 413 B12R1.30 C=CC=CC(=O)N1CCOCC1 1626a_100015191051_100016291481 [0,0,1,0,0,0|3,0,0]=4 414 B12R1.30 C=CCCN(C)c1ncccn1 27a_100020639649_100000211032 [0,0,1,0,0,0|1,0,1]=3 415 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000210012_100000210211 [0,0,1,0,0,0|3,0,0]=4 416 B12R1.30 CCCCN(C)c1ccccc1 2230a_100000211623_200000210301 [0,0,1,0,0,0|3,0,0]=4 417 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000210012_100000210211 [0,0,1,0,0,0|3,0,0]=4 418 B12R1.30 CCCCN(C)c1ccccc1 269982a_100000211623_200000210301 [0,0,1,0,0,0|3,0,0]=4 419 B12R1.30 CCCCN(C)c1ccccc1 34a_100000210012_100000210210 [0,0,1,0,0,0|3,0,0]=4 420 B12R1.30 CCCCN(C)c1ccccc1 34a_100000211623_200000210301 [0,0,1,0,0,0|3,0,0]=4 421 B12R1.30 CCCCN(C)c1cccnn1 27a_100000207549_100016991348 [0,0,1,0,0,0|3,0,0]=4 422 B12R1.30 CCCCN(C)c1ccncn1 27a_100000207549_100000703185 [0,0,1,0,0,0|3,0,0]=4 423 B12R1.30 CCCCN(C)c1cnccn1 27a_100000207549_100000211759 [0,0,1,0,0,0|3,0,0]=4 424 B12R1.30 CCCCN(C)c1ncccn1 27a_100000207549_100000211032 [0,0,1,0,0,0|1,0,0]=2 425 B12R1.30 CCCCN([13CH3])c1ccccc1 2230a_100000211623_200025704644 [0,0,1,0,0,0|3,0,0]=4 426 B12R1.30 CCCCN([13CH3])c1ccccc1 269982a_100000211623_200025704644 [0,0,1,0,0,0|3,0,0]=4 427 B12R1.30 CCCCN([13CH3])c1ccccc1 34a_100000211623_200025704644 [0,0,1,0,0,0|3,0,0]=4 428 B12R1.30 CCCNC(C)c1ncccn1 2230a_100020641698_100000210303 [0,0,1,0,0,0|3,0,0]=4 429 B12R1.30 CCCNC(C)c1ncccn1 270004a_100020643023_100011350828 [0,0,1,0,0,0|3,0,0]=4 430 B12R1.30 CN(CCC#N)c1ncccn1 27a_100000184479_100000211032 [0,0,1,0,0,0|2,0,0]=3 431 B12R1.30 CN(CCCO)c1ncccn1 27a_100000213112_100000211032 [0,0,1,0,0,0|2,0,0]=3 432 B12R1.30 CNCCC(C)c1ccccc1 270004a_106832991635_100000189432 [0,0,1,0,0,0|3,0,0]=4 433 B12R1.30 COCCN(C)c1ccccc1 2230a_100000210012_100011201679 [0,0,1,0,0,0|3,0,0]=4 434 B12R1.30 COCCN(C)c1ccccc1 269982a_100000210012_100000233755 [0,0,1,0,0,0|3,0,0]=4 435 B12R1.30 COCCN(C)c1ccccc1 34a_100000210012_100011201679 [0,0,1,0,0,0|3,0,0]=4 436 B12R1.30 COCCN(C)c1cccnn1 27a_100000743101_100016991348 [0,0,1,0,0,0|3,0,0]=4 437 B12R1.30 COCCN(C)c1ccncn1 27a_100000743101_100000703185 [0,0,1,0,0,0|3,0,0]=4 438 B12R1.30 COCCN(C)c1cnccn1 27a_100000743101_100000211759 [0,0,1,0,0,0|3,0,0]=4 439 B12R1.30 COCCN(C)c1ncccn1 27a_100000743101_100000211032 [0,0,1,0,0,0|1,0,0]=2 440 B12R1.30 COCNC(C)c1ncccn1 2230a_100020641698_100000766300 [0,0,1,0,0,0|3,0,0]=4 441 B12R1.30 CSCCN(C)c1ccccc1 2230a_100000210012_100000751147 [0,0,1,0,0,0|3,0,0]=4 442 B12R1.30 CSCCN(C)c1ccccc1 269982a_100000210012_100000212216 [0,0,1,0,0,0|3,0,0]=4 443 B12R1.30 CSCCN(C)c1ccccc1 34a_100000210012_100000212216 [0,0,1,0,0,0|3,0,0]=4 444 B12R1.30 CSCCN(C)c1cccnn1 27a_100000686725_100016991348 [0,0,1,0,0,0|3,0,0]=4 445 B12R1.30 CSCCN(C)c1ccncn1 27a_100000686725_100000703185 [0,0,1,0,0,0|3,0,0]=4 446 B12R1.30 CSCCN(C)c1cnccn1 27a_100000686725_100000211759 [0,0,1,0,0,0|3,0,0]=4 447 B12R1.30 CSCCN(C)c1ncccn1 27a_100000686725_100000211032 [0,0,1,0,0,0|1,0,0]=2 448 B12R1.30 CSCNC(C)c1ncccn1 2230a_100020641698_100011218213 [0,0,1,0,0,0|3,0,0]=4 449 B14R3.2932 c1cc(ncn1)N2CC3CC3C2 27a_100000741873_100000703185 [0,0,0,1,0,0|3,0,0]=4 450 B14R3.2932 c1cnc(cn1)N2CC3CC3C2 27a_100000741873_100000211759 [0,0,0,1,0,0|3,0,0]=4 451 B14R3.2932 c1cnc(nc1)N2CC3CC3C2 27a_100000741873_100000211032 [0,0,0,1,0,0|1,0,0]=2 452 B14R3.2932 c1cnnc(c1)N2CC3CC3C2 27a_100000741873_100016991348 [0,0,0,1,0,0|3,0,0]=4 453 B12R2.2 C1=C(CCC1)c2ccccn2 271570a_100000089523_100011216584 [0,0,0,0,1,0|2,0,1]=4 454 B12R2.2 C1=C(CCC1)c2ncccn2 271570a_100000089523_100000211032 [0,0,0,0,1,0|1,0,1]=3 455 B12R2.2 C1=C(CCNC1)c2c[nH]cn2 271570a_100000731432_100000756875 [0,0,0,0,1,0|2,0,1]=4 456 B12R2.2 C1=C(CCNC1)c2cc[nH]n2 271570a_100000731432_100000062575 [0,0,0,0,1,0|2,0,1]=4 457 B12R2.2 C1=C(CCNC1)c2ccco2 271570a_100000731432_100009814098 [0,0,0,0,1,0|2,0,1]=4 458 B12R2.2 C1=C(CCNC1)c2cccs2 271570a_100000731432_100011215356 [0,0,0,0,1,0|2,0,1]=4 459 B12R2.2 C1=C(CCNC1)c2ccsn2 271570a_100000731432_100009818082 [0,0,0,0,1,0|2,0,1]=4 460 B12R2.2 C1=C(CCNC1)c2cscn2 271570a_100000731432_100000751502 [0,0,0,0,1,0|2,0,1]=4 461 B12R2.2 C1=C(CCNC1)c2nc[nH]n2 271570a_100000731432_100000761765 [0,0,0,0,1,0|2,0,1]=4 462 B12R2.2 C1=C(CCNC1)c2ncc[nH]2 271570a_100000731432_100025796157 [0,0,0,0,1,0|1,0,2]=4 463 B12R2.2 C1=C(CCNC1)c2ncco2 271570a_100000731432_100011787736 [0,0,0,0,1,0|2,0,1]=4 464 B12R2.2 C1=C(CCNC1)c2nccs2 271570a_100000731432_100000211983 [0,0,0,0,1,0|2,0,1]=4 465 B12R2.2 C1=C(CCO1)c2ncccn2 271570a_100000118173_100000211032 [0,0,0,0,1,0|2,0,1]=4 466 B12R2.2 C1=C(COC1)c2ncccn2 271570a_100009872500_100000211032 [0,0,0,0,1,0|2,0,1]=4 467 B12R2.2 C1=CCN(C1)c2ncccn2 27a_100015195280_100000211032 [0,0,0,0,1,0|0,0,2]=3 468 B12R2.2 c1cc(ncn1)N2CCCC2 27a_100000188435_100000703185 [0,0,0,0,1,0|2,0,0]=3 469 B12R2.2 c1cc(ncn1)N2CCSC2 27a_100011215254_100000703185 [0,0,0,0,1,0|3,0,0]=4 470 B12R2.2 c1cnc(cn1)N2CCCC2 27a_100000188435_100000211759 [0,0,0,0,1,0|2,0,0]=3 471 B12R2.2 c1cnc(cn1)N2CCSC2 27a_100011215254_100000211759 [0,0,0,0,1,0|3,0,0]=4 472 B12R2.2 c1cnc(nc1)N2CCCC2 27a_100000188435_100000211032 [0,0,0,0,1,0|0,0,0]=1 473 B12R2.2 c1cnc(nc1)N2CCSC2 27a_100011215254_100000211032 [0,0,0,0,1,0|1,0,0]=2 474 B12R2.2 c1cnnc(c1)N2CCCC2 27a_100000188435_100016991348 [0,0,0,0,1,0|2,0,0]=3 475 B12R2.2 c1cnnc(c1)N2CCSC2 27a_100011215254_100016991348 [0,0,0,0,1,0|3,0,0]=4 476 B12R2.2 c1nnc(s1)N2CCOCC2 27a_100015191051_100000739804 [0,0,0,0,1,0|3,0,0]=4 477 B12R2.2 c1nnc(s1)N2CCSCC2 27a_100000737611_100000739804 [0,0,0,0,1,0|3,0,0]=4 478 B12R2.2 c1nsc(n1)N2CCOCC2 27a_100015191051_100000693119 [0,0,0,0,1,0|3,0,0]=4 479 B12R2.2 c1nsc(n1)N2CCSCC2 27a_100000737611_100000693119 [0,0,0,0,1,0|3,0,0]=4 480 B14R2.6 C1=CCN(CC1)Cc2ccccn2 2230a_100000698166_100000721315 [0,0,0,0,0,1|2,0,1]=4 481 B14R2.6 C1=CCN(CC1)Cc2ccccn2 269982a_100000698166_100000721315 [0,0,0,0,0,1|2,0,1]=4 482 B14R2.6 C1=CCN(CC1)Cc2ccccn2 270004a_100000698166_100000209966 [0,0,0,0,0,1|2,0,1]=4 483 B14R2.6 C1=CCN(CC1)Cc2ccccn2 34a_100000698166_100000721315 [0,0,0,0,0,1|2,0,1]=4 484 B14R2.6 C1=CCN(CC1)Cc2ncccn2 2230a_100000698166_100000703007 [0,0,0,0,0,1|1,0,1]=3 485 B14R2.6 C1=CCN(CC1)Cc2ncccn2 269982a_100000698166_100000703007 [0,0,0,0,0,1|1,0,1]=3 486 B14R2.6 C1=CCN(CC1)Cc2ncccn2 270004a_100000698166_100011532527 [0,0,0,0,0,1|1,0,1]=3 487 B14R2.6 C1=CCN(CC1)Cc2ncccn2 34a_100000698166_100000703007 [0,0,0,0,0,1|1,0,1]=3 488 B14R2.6 c1ccc(cc1)CN2CCOCC2 2230a_100015191051_100015291786 [0,0,0,0,0,1|3,0,0]=4 489 B14R2.6 c1ccc(cc1)CN2CCOCC2 269982a_100015191051_100000211182 [0,0,0,0,0,1|3,0,0]=4 490 B14R2.6 c1ccc(cc1)CN2CCOCC2 270004a_100015191051_100015611070 [0,0,0,0,0,1|3,0,0]=4 491 B14R2.6 c1ccc(cc1)CN2CCOCC2 34a_100015191051_100015291786 [0,0,0,0,0,1|3,0,0]=4 492 B14R2.6 c1ccc(cc1)CN2CCSCC2 2230a_100000737611_100015291786 [0,0,0,0,0,1|3,0,0]=4 493 B14R2.6 c1ccc(cc1)CN2CCSCC2 269982a_100000737611_100000211182 [0,0,0,0,0,1|3,0,0]=4 494 B14R2.6 c1ccc(cc1)CN2CCSCC2 270004a_100000737611_100015611070 [0,0,0,0,0,1|3,0,0]=4 495 B14R2.6 c1ccc(nc1)CN2CCCOC2 2230a_100000131196_100000721315 [0,0,0,0,0,1|3,0,0]=4 496 B14R2.6 c1ccc(nc1)CN2CCCOC2 269982a_100000131196_100000721315 [0,0,0,0,0,1|3,0,0]=4 497 B14R2.6 c1ccc(nc1)CN2CCCOC2 270004a_100000131196_100000209966 [0,0,0,0,0,1|3,0,0]=4 498 B14R2.6 c1ccc(nc1)CN2CCCOC2 34a_100000131196_100000721315 [0,0,0,0,0,1|3,0,0]=4 499 B14R2.6 c1ccc(nc1)CN2CCOCC2 2230a_100015191051_100000721315 [0,0,0,0,0,1|2,0,0]=3 500 B14R2.6 c1ccc(nc1)CN2CCOCC2 269982a_100015191051_100000721315 [0,0,0,0,0,1|2,0,0]=3 501 B14R2.6 c1ccc(nc1)CN2CCOCC2 270004a_100015191051_100000209966 [0,0,0,0,0,1|2,0,0]=3 502 B14R2.6 c1ccc(nc1)CN2CCOCC2 34a_100015191051_100000721315 [0,0,0,0,0,1|2,0,0]=3 503 B14R2.6 c1ccc(nc1)CN2CCSCC2 2230a_100000737611_100000721315 [0,0,0,0,0,1|2,0,0]=3 504 B14R2.6 c1ccc(nc1)CN2CCSCC2 269982a_100000737611_100000721315 [0,0,0,0,0,1|2,0,0]=3 505 B14R2.6 c1ccc(nc1)CN2CCSCC2 270004a_100000737611_100000209966 [0,0,0,0,0,1|2,0,0]=3 506 B14R2.6 c1ccc(nc1)SC2CCCCC2 62a_100000210327_100011216584 [0,0,0,0,0,1|3,0,0]=4 507 B14R2.6 c1ccc(nc1)SC2CCCCC2 62a_100011216584_100000210327 [0,0,0,0,0,1|3,0,0]=4 508 B14R2.6 c1ccc(nc1)SC2CCOCC2 62a_100011216584_100011324220 [0,0,0,0,0,1|3,0,0]=4 509 B14R2.6 c1ccc(nc1)SC2CCSCC2 62a_100011216584_100000069128 [0,0,0,0,0,1|3,0,0]=4 510 B14R2.6 c1cnc(cn1)CN2CCOCC2 2230a_100015191051_100016995436 [0,0,0,0,0,1|3,0,0]=4 511 B14R2.6 c1cnc(cn1)CN2CCOCC2 269982a_100015191051_100016995436 [0,0,0,0,0,1|3,0,0]=4 512 B14R2.6 c1cnc(cn1)CN2CCOCC2 270004a_100015191051_100000749867 [0,0,0,0,0,1|3,0,0]=4 513 B14R2.6 c1cnc(cn1)CN2CCOCC2 34a_100015191051_100016995436 [0,0,0,0,0,1|3,0,0]=4 514 B14R2.6 c1cnc(cn1)CN2CCSCC2 2230a_100000737611_100016995436 [0,0,0,0,0,1|3,0,0]=4 515 B14R2.6 c1cnc(cn1)CN2CCSCC2 269982a_100000737611_100016995436 [0,0,0,0,0,1|3,0,0]=4 516 B14R2.6 c1cnc(cn1)CN2CCSCC2 270004a_100000737611_100000749867 [0,0,0,0,0,1|3,0,0]=4 517 B14R2.6 c1cnc(nc1)CN2CCCOC2 2230a_100000131196_100000703007 [0,0,0,0,0,1|2,0,0]=3 518 B14R2.6 c1cnc(nc1)CN2CCCOC2 269982a_100000131196_100000703007 [0,0,0,0,0,1|2,0,0]=3 519 B14R2.6 c1cnc(nc1)CN2CCCOC2 270004a_100000131196_100011532527 [0,0,0,0,0,1|2,0,0]=3 520 B14R2.6 c1cnc(nc1)CN2CCCOC2 34a_100000131196_100000703007 [0,0,0,0,0,1|2,0,0]=3 521 B14R2.6 c1cnc(nc1)CN2CCOCC2 2230a_100015191051_100000703007 [0,0,0,0,0,1|1,0,0]=2 522 B14R2.6 c1cnc(nc1)CN2CCOCC2 269982a_100015191051_100000703007 [0,0,0,0,0,1|1,0,0]=2 523 B14R2.6 c1cnc(nc1)CN2CCOCC2 270004a_100015191051_100011532527 [0,0,0,0,0,1|1,0,0]=2 524 B14R2.6 c1cnc(nc1)CN2CCOCC2 34a_100015191051_100000703007 [0,0,0,0,0,1|1,0,0]=2 525 B14R2.6 c1cnc(nc1)CN2CCSCC2 2230a_100000737611_100000703007 [0,0,0,0,0,1|1,0,0]=2 526 B14R2.6 c1cnc(nc1)CN2CCSCC2 269982a_100000737611_100000703007 [0,0,0,0,0,1|1,0,0]=2 527 B14R2.6 c1cnc(nc1)CN2CCSCC2 270004a_100000737611_100011532527 [0,0,0,0,0,1|1,0,0]=2 528 B14R2.6 c1cnc(nc1)NC2CCCCC2 27a_100000182618_100000211032 [0,0,0,0,0,1|2,0,0]=3 529 B14R2.6 c1cnc(nc1)NC2CCCOC2 27a_100000719290_100000211032 [0,0,0,0,0,1|3,0,0]=4 530 B14R2.6 c1cnc(nc1)NC2CCOCC2 27a_100000741149_100000211032 [0,0,0,0,0,1|2,0,0]=3 531 B14R2.6 c1cnc(nc1)NC2CCSCC2 27a_100000748639_100000211032 [0,0,0,0,0,1|2,0,0]=3 532 B14R2.6 c1cnc(nc1)SC2CCCCC2 62a_100000210327_100000211032 [0,0,0,0,0,1|2,0,0]=3 533 B14R2.6 c1cnc(nc1)SC2CCCCC2 62a_100000211032_100000210327 [0,0,0,0,0,1|2,0,0]=3 534 B14R2.6 c1cnc(nc1)SC2CCCOC2 62a_100000211032_100000693364 [0,0,0,0,0,1|3,0,0]=4 535 B14R2.6 c1cnc(nc1)SC2CCOCC2 62a_100000211032_100011324220 [0,0,0,0,0,1|2,0,0]=3 536 B14R2.6 c1cnc(nc1)SC2CCSCC2 62a_100000211032_100000069128 [0,0,0,0,0,1|2,0,0]=3 537 B14R2.6 c1cnnc(c1)CN2CCOCC2 2230a_100015191051_100016990269 [0,0,0,0,0,1|3,0,0]=4 538 B14R2.6 c1cnnc(c1)CN2CCOCC2 34a_100015191051_100016990269 [0,0,0,0,0,1|3,0,0]=4 539 B14R2.6 c1cnnc(c1)CN2CCSCC2 2230a_100000737611_100016990269 [0,0,0,0,0,1|3,0,0]=4 540 B14R2.1253 C1=C(CCCCC1)c2ccccn2 271570a_200009888920_100011216584 [0,0,0,0,0,1|3,0,0]=4 541 B14R2.1253 C1=C(CCCCC1)c2ncccn2 271570a_200009888920_100000211032 [0,0,0,0,0,1|2,0,0]=3 542 B14R2.1253 c1cc(ncn1)N2CCCCCC2 27a_100000185865_100000703185 [0,0,0,0,0,1|3,0,0]=4 543 B14R2.1253 c1cc(ncn1)N2CCCOCC2 27a_100000685342_100000703185 [0,0,0,0,0,1|3,0,0]=4 544 B14R2.1253 c1cnc(cn1)N2CCCCCC2 27a_100000185865_100000211759 [0,0,0,0,0,1|3,0,0]=4 545 B14R2.1253 c1cnc(cn1)N2CCCOCC2 27a_100000685342_100000211759 [0,0,0,0,0,1|3,0,0]=4 546 B14R2.1253 c1cnc(nc1)N2CCCCCC2 27a_100000185865_100000211032 [0,0,0,0,0,1|1,0,0]=2 547 B14R2.1253 c1cnc(nc1)N2CCCOCC2 27a_100000685342_100000211032 [0,0,0,0,0,1|1,0,0]=2 548 B14R2.1253 c1cnnc(c1)N2CCCCCC2 27a_100000185865_100016991348 [0,0,0,0,0,1|3,0,0]=4 549 B14R2.1253 c1cnnc(c1)N2CCCOCC2 27a_100000685342_100016991348 [0,0,0,0,0,1|3,0,0]=4 550 B11R1.12 CCC(NC)c1ncccn1 269862a_106832991636_200011350823 [1,0,1,0,0,0|2,0,0]=4 551 B11R1.12 CCC(NC)c1ncccn1 270004a_106832991635_200011350823 [1,0,1,0,0,0|2,0,0]=4 552 B11R1.12 CCN(CC)c1ccccc1 2230a_100000210013_100000210202 [1,0,1,0,0,0|2,0,0]=4 553 B11R1.12 CCN(CC)c1ccccc1 269982a_100000210013_100000204670 [1,0,1,0,0,0|2,0,0]=4 554 B11R1.12 CCN(CC)c1ccccc1 34a_100000210013_100000210202 [1,0,1,0,0,0|2,0,0]=4 555 B11R1.12 CCN(CC)c1cccnn1 27a_100000724800_100016991348 [1,0,1,0,0,0|2,0,0]=4 556 B11R1.12 CCN(CC)c1ccncn1 27a_100000724800_100000703185 [1,0,1,0,0,0|2,0,0]=4 557 B11R1.12 CCN(CC)c1cnccn1 27a_100000724800_100000211759 [1,0,1,0,0,0|2,0,0]=4 558 B11R1.12 CCN(CC)c1ncccn1 27a_100000724800_100000211032 [1,0,1,0,0,0|0,0,0]=2 559 B11R1.16 C#CCN(C)c1ncccn1 27a_100000225692_100000211032 [1,0,1,0,0,0|0,0,2]=4 560 B11R1.16 CCCN(C)c1ccccc1 2230a_100000210012_100000210303 [1,0,1,0,0,0|2,0,0]=4 561 B11R1.16 CCCN(C)c1ccccc1 2230a_200011218496_200000210301 [1,0,1,0,0,0|2,0,0]=4 562 B11R1.16 CCCN(C)c1ccccc1 269982a_100000210012_100000210303 [1,0,1,0,0,0|2,0,0]=4 563 B11R1.16 CCCN(C)c1ccccc1 269982a_200011218496_200000210301 [1,0,1,0,0,0|2,0,0]=4 564 B11R1.16 CCCN(C)c1ccccc1 34a_100000210012_100000210303 [1,0,1,0,0,0|2,0,0]=4 565 B11R1.16 CCCN(C)c1ccccc1 34a_200011218496_200000210301 [1,0,1,0,0,0|2,0,0]=4 566 B11R1.16 CCCN(C)c1cccnn1 27a_100000747261_100016991348 [1,0,1,0,0,0|2,0,0]=4 567 B11R1.16 CCCN(C)c1ccncn1 27a_100000747261_100000703185 [1,0,1,0,0,0|2,0,0]=4 568 B11R1.16 CCCN(C)c1cnccn1 27a_100000747261_100000211759 [1,0,1,0,0,0|2,0,0]=4 569 B11R1.16 CCCN(C)c1ncccn1 27a_100000747261_100000211032 [1,0,1,0,0,0|0,0,0]=2 570 B11R1.16 CCCN([13CH3])c1ccccc1 2230a_200011218496_200025704644 [1,0,1,0,0,0|2,0,0]=4 571 B11R1.16 CCCN([13CH3])c1ccccc1 269982a_200011218496_200025704644 [1,0,1,0,0,0|2,0,0]=4 572 B11R1.16 CCCN([13CH3])c1ccccc1 34a_200011218496_200025704644 [1,0,1,0,0,0|2,0,0]=4 573 B11R1.16 CCNC(C)c1ncccn1 2230a_100020641698_100000210202 [1,0,1,0,0,0|2,0,0]=4 574 B11R1.16 CCNC(C)c1ncccn1 270004a_100015525214_100011350828 [1,0,1,0,0,0|2,0,0]=4 575 B11R1.16 CN(CCO)c1ncccn1 27a_100000210263_100000211032 [1,0,1,0,0,0|1,0,0]=3 576 B11R1.28 C#CCCNc1ncccn1 27a_100000755551_100000211032 [1,0,1,0,0,0|0,0,2]=4 577 B11R1.28 C=CCCNc1ncccn1 27a_100015191253_100000211032 [1,0,1,0,0,0|0,0,2]=4 578 B11R1.28 CC#CCNc1ncccn1 27a_100000685387_100000211032 [1,0,1,0,0,0|0,0,2]=4 579 B11R1.28 CCC=NNc1ncccn1 4a_100000736892_100000210100 [1,0,1,0,0,0|1,0,1]=4 580 B11R1.28 CCCC=Cc1ncccn1 271570a_100016258520_100000211032 [1,0,1,0,0,0|1,0,1]=4 581 B11R1.28 CCCCNc1ccccc1 34a_100000106764_100000210210 [1,0,1,0,0,0|2,0,0]=4 582 B11R1.28 CCCCNc1cccnn1 27a_100000102301_100016991348 [1,0,1,0,0,0|2,0,0]=4 583 B11R1.28 CCCCNc1ccncn1 27a_100000102301_100000703185 [1,0,1,0,0,0|2,0,0]=4 584 B11R1.28 CCCCNc1cnccn1 27a_100000102301_100000211759 [1,0,1,0,0,0|2,0,0]=4 585 B11R1.28 CCCCNc1ncccn1 27a_100000102301_100000211032 [1,0,1,0,0,0|0,0,0]=2 586 B11R1.28 CCCCSc1ccccn1 62a_100000210211_100011216584 [1,0,1,0,0,0|2,0,0]=4 587 B11R1.28 CCCCSc1ccccn1 62a_100011216584_100000210210 [1,0,1,0,0,0|2,0,0]=4 588 B11R1.28 CCCCSc1ncccn1 62a_100000210211_100000211032 [1,0,1,0,0,0|1,0,0]=3 589 B11R1.28 CCCCSc1ncccn1 62a_100000211032_100000210210 [1,0,1,0,0,0|1,0,0]=3 590 B11R1.28 CCCNCc1ncccn1 270004a_100020643023_100011532527 [1,0,1,0,0,0|2,0,0]=4 591 B11R1.28 CCCOCc1ncccn1 34a_100000210258_100000703007 [1,0,1,0,0,0|2,0,0]=4 592 B11R1.28 CCCSCc1ncccn1 62a_100000210303_100000703007 [1,0,1,0,0,0|2,0,0]=4 593 B11R1.28 CCCSCc1ncccn1 62a_100000703007_100000210303 [1,0,1,0,0,0|2,0,0]=4 594 B11R1.28 CCNCCc1ccccc1 2230a_100000106460_100000210202 [1,0,1,0,0,0|2,0,0]=4 595 B11R1.28 CCNCCc1ccccc1 2230a_100015525214_100000765856 [1,0,1,0,0,0|2,0,0]=4 596 B11R1.28 CCNCCc1ccccc1 34a_100000106460_100000210202 [1,0,1,0,0,0|2,0,0]=4 597 B11R1.28 CCNCCc1ccccn1 2230a_100015525214_100015183660 [1,0,1,0,0,0|1,0,0]=3 598 B11R1.28 CCNN=Cc1ncccn1 4a_100000756455_100011532527 [1,0,1,0,0,0|1,0,1]=4 599 B11R1.28 CCOCCc1ccccn1 34a_100000210271_100000210202 [1,0,1,0,0,0|2,0,0]=4 600 B11R1.28 CCOCSc1ncccn1 62a_100000211032_100000739092 [1,0,1,0,0,0|2,0,0]=4 601 B11R1.28 CCOCSc1ncccn1 62a_100000739092_100000211032 [1,0,1,0,0,0|2,0,0]=4 602 B11R1.28 CCSCCc1ccccn1 62a_100000210202_100015183660 [1,0,1,0,0,0|2,0,0]=4 603 B11R1.28 CCSCCc1ccccn1 62a_100015183660_100000210202 [1,0,1,0,0,0|2,0,0]=4 604 B11R1.28 CNCCOc1ccccn1 2230a_106741647558_200000210301 [1,0,1,0,0,0|2,0,0]=4 605 B11R1.28 COCCNc1ncccn1 27a_100000209980_100000211032 [1,0,1,0,0,0|1,0,0]=3 606 B11R1.28 COCCSc1ncccn1 62a_100000211032_100000233755 [1,0,1,0,0,0|2,0,0]=4 607 B11R1.28 COCCSc1ncccn1 62a_100000233755_100000211032 [1,0,1,0,0,0|2,0,0]=4 608 B11R1.28 CSCCNc1ncccn1 27a_100020590264_100000211032 [1,0,1,0,0,0|1,0,0]=3 609 B11R1.28 CSCCSc1ncccn1 62a_100000211032_100000751147 [1,0,1,0,0,0|2,0,0]=4 610 B11R1.28 CSCCSc1ncccn1 62a_100000212216_100000211032 [1,0,1,0,0,0|2,0,0]=4 611 B11R1.28 FCCCNc1ncccn1 27a_100015189416_100000211032 [1,0,1,0,0,0|1,0,0]=3 612 B11R1.28 FCCCSc1ncccn1 62a_100000211032_100011934791 [1,0,1,0,0,0|2,0,0]=4 613 B11R1.28 FCCCSc1ncccn1 62a_100011934791_100000211032 [1,0,1,0,0,0|2,0,0]=4 614 B11R1.28 N#CCCNc1ncccn1 27a_100000720768_100000211032 [1,0,1,0,0,0|1,0,1]=4 615 B11R1.28 OCCCNc1ncccn1 27a_100000182051_100000211032 [1,0,1,0,0,0|1,0,0]=3 616 B11R1.28 OCCCSc1ncccn1 62a_100000211032_100011215043 [1,0,1,0,0,0|2,0,0]=4 617 B11R1.28 OCCCSc1ncccn1 62a_100011215043_100000211032 [1,0,1,0,0,0|2,0,0]=4 618 B11R1.28 [13CH3]NCCOc1ccccn1 2230a_106741647558_200025704644 [1,0,1,0,0,0|2,0,0]=4 619 B13R1.1 C#CCN(CC)c1ncc(cn1)Br 27a_100000744766_100000690281 [0,1,1,0,0,0|1,0,1]=4 620 B13R1.1 C#CCN(CC)c1ncc(cn1)C 27a_100000744766_100000061069 [0,1,1,0,0,0|1,0,1]=4 621 B13R1.1 C#CCN(CC)c1ncc(cn1)Cl 27a_100000744766_100011356929 [0,1,1,0,0,0|1,0,1]=4 622 B13R1.1 C#CCN(CC)c1ncc(cn1)F 27a_100000744766_100000685220 [0,1,1,0,0,0|1,0,1]=4 623 B13R1.1 CCCN(CC)c1ccc(cn1)Br 27a_100000226822_100000686858 [0,1,1,0,0,0|2,0,0]=4 624 B13R1.1 CCCN(CC)c1ncc(cn1)Br 27a_100000226822_100000690281 [0,1,1,0,0,0|1,0,0]=3 625 B13R1.1 CCCN(CC)c1ncc(cn1)C 27a_100000226822_100000061069 [0,1,1,0,0,0|1,0,0]=3 626 B13R1.1 CCCN(CC)c1ncc(cn1)Cl 27a_100000226822_100011356929 [0,1,1,0,0,0|1,0,0]=3 627 B13R1.1 CCCN(CC)c1ncc(cn1)F 27a_100000226822_100000685220 [0,1,1,0,0,0|1,0,0]=3 628 B13R1.1 CCN(CCO)c1ccc(cn1)Br 27a_100000210973_100000686858 [0,1,1,0,0,0|2,0,0]=4 629 B13R1.1 CCN(CCO)c1ncc(cn1)Br 27a_100000210973_100000690281 [0,1,1,0,0,0|1,0,0]=3 630 B13R1.1 CCN(CCO)c1ncc(cn1)C 27a_100000210973_100000061069 [0,1,1,0,0,0|1,0,0]=3 631 B13R1.1 CCN(CCO)c1ncc(cn1)Cl 27a_100000210973_100011356929 [0,1,1,0,0,0|1,0,0]=3 632 B13R1.1 CCN(CCO)c1ncc(cn1)F 27a_100000210973_100000685220 [0,1,1,0,0,0|1,0,0]=3 633 B13R1.2 C#CCN(CC)c1nccc(n1)C 27a_100000744766_100000750684 [0,1,1,0,0,0|1,0,1]=4 634 B13R1.2 C#CCN(CC)c1nccc(n1)N 27a_100000744766_100000757536 [0,1,1,0,0,0|1,0,1]=4 635 B13R1.2 C#CCN(CC)c1nccc(n1)O 27a_100000744766_100011649813 [0,1,1,0,0,0|1,0,1]=4 636 B13R1.2 CCCN(CC)c1cc(ccn1)F 27a_100000226822_100000764206 [0,1,1,0,0,0|2,0,0]=4 637 B13R1.2 CCCN(CC)c1cccc(n1)F 27a_100000226822_100009815982 [0,1,1,0,0,0|2,0,0]=4 638 B13R1.2 CCCN(CC)c1nccc(n1)C 27a_100000226822_100000750684 [0,1,1,0,0,0|1,0,0]=3 639 B13R1.2 CCCN(CC)c1nccc(n1)N 27a_100000226822_100000757536 [0,1,1,0,0,0|1,0,0]=3 640 B13R1.2 CCCN(CC)c1nccc(n1)O 27a_100000226822_100011649813 [0,1,1,0,0,0|1,0,0]=3 641 B13R1.2 CCCN(CC)c1ncnc(n1)N 27a_100000226822_100000123831 [0,1,1,0,0,0|2,0,0]=4 642 B13R1.2 CCN(CCO)c1cc(ccn1)F 27a_100000210973_100000764206 [0,1,1,0,0,0|2,0,0]=4 643 B13R1.2 CCN(CCO)c1cccc(n1)F 27a_100000210973_100009815982 [0,1,1,0,0,0|2,0,0]=4 644 B13R1.2 CCN(CCO)c1nccc(n1)C 27a_100000210973_100000750684 [0,1,1,0,0,0|1,0,0]=3 645 B13R1.2 CCN(CCO)c1nccc(n1)N 27a_100000210973_100000757536 [0,1,1,0,0,0|1,0,0]=3 646 B13R1.2 CCN(CCO)c1nccc(n1)O 27a_100000210973_100011649813 [0,1,1,0,0,0|1,0,0]=3 647 B13R1.2 CCN(CCO)c1ncnc(n1)N 27a_100000210973_100000123831 [0,1,1,0,0,0|2,0,0]=4 648 B13R1.26 CCC(NCCF)c1ncccn1 269862a_100000724931_200011350823 [0,1,1,0,0,0|2,0,0]=4 649 B13R1.26 CCC(NCCO)c1ncccn1 269862a_100000210304_200011350823 [0,1,1,0,0,0|2,0,0]=4 650 B13R1.26 CCC(NCCO)c1ncccn1 270004a_100000210304_200011350823 [0,1,1,0,0,0|2,0,0]=4 651 B13R1.26 CCCCN(CC)c1ncccn1 27a_100000207695_100000211032 [0,1,1,0,0,0|1,0,0]=3 652 B13R1.26 CCCNC(CC)c1ncccn1 269862a_100020643023_200011350823 [0,1,1,0,0,0|2,0,0]=4 653 B13R1.26 CCCNC(CC)c1ncccn1 270004a_100020643023_200011350823 [0,1,1,0,0,0|2,0,0]=4 654 B13R1.26 CCN(CCC#N)c1ncccn1 27a_100000226048_100000211032 [0,1,1,0,0,0|0,0,1]=3 655 B13R1.26 CCN(CCOC)c1ncccn1 27a_100000731262_100000211032 [0,1,1,0,0,0|1,0,0]=3 656 B13R1.173 CCCN(CC)c1ncccc1Br 27a_100000226822_100000696092 [0,1,1,0,0,0|2,0,0]=4 657 B13R1.173 CCN(CCO)c1ncccc1Br 27a_100000210973_100000696092 [0,1,1,0,0,0|2,0,0]=4 658 B13R1.398 CCCN(CCC)c1ncccn1 27a_100000210455_100000211032 [0,1,1,0,0,0|1,0,0]=3 659 B13R1.398 CCCN(CCO)c1ncccn1 27a_100000211420_100000211032 [0,1,1,0,0,0|1,0,0]=3 660 B13R1.398 OCCN(CCO)c1ncccn1 27a_100000210587_100000211032 [0,1,1,0,0,0|1,0,0]=3 661 B13R1.405 C=CCN(c1ncccn1)C(C)C 27a_100000742772_100000211032 [0,1,1,0,0,0|1,0,1]=4 662 B13R1.405 CC(C)N(CCO)c1ncccn1 27a_100000224655_100000211032 [0,1,1,0,0,0|1,0,0]=3 663 B13R1.405 CCCN(c1ncccn1)C(C)C 27a_106256033942_100000211032 [0,1,1,0,0,0|1,0,0]=3 664 B13R1.532 CCC(C)N(CC)c1ncccn1 27a_100000732650_100000211032 [0,1,1,0,0,0|1,0,0]=3 665 B13R1.532 CCN(c1ncccn1)C(C)CO 27a_100000731049_100000211032 [0,1,1,0,0,0|1,0,0]=3 666 B13R1.713 C=C(C)CN(CC)c1ncccn1 27a_100000211296_100000211032 [0,1,1,0,0,0|1,0,1]=4 667 B13R1.713 CCN(CC(C)C)c1ncccn1 27a_100000738554_100000211032 [0,1,1,0,0,0|1,0,0]=3 668 B13R1.713 CCN(C[C@H](C)O)c1ncccn1 27a_100000729506_100000211032 [0,1,1,0,0,0|1,0,0]=3 669 B13R1.6 CCCCCNc1cc(ccn1)F 27a_100000209983_100000764206 [0,1,1,0,0,0|2,0,0]=4 670 B13R1.6 CCCCCNc1cccc(n1)F 27a_100000209983_100009815982 [0,1,1,0,0,0|2,0,0]=4 671 B13R1.6 CCCCCNc1nccc(n1)C 27a_100000209983_100000750684 [0,1,1,0,0,0|1,0,0]=3 672 B13R1.6 CCCCCNc1nccc(n1)N 27a_100000209983_100000757536 [0,1,1,0,0,0|1,0,0]=3 673 B13R1.6 CCCCCNc1nccc(n1)O 27a_100000209983_100011649813 [0,1,1,0,0,0|1,0,0]=3 674 B13R1.6 CCCCCNc1ncnc(n1)N 27a_100000209983_100000123831 [0,1,1,0,0,0|2,0,0]=4 675 B13R1.6 CCCCCSc1nccc(n1)C 62a_100000210326_100011243806 [0,1,1,0,0,0|2,0,0]=4 676 B13R1.6 CCCCCSc1nccc(n1)C 62a_100011243806_100000210326 [0,1,1,0,0,0|2,0,0]=4 677 B13R1.6 CCCCCSc1nccc(n1)N 62a_100000210326_100000757536 [0,1,1,0,0,0|2,0,0]=4 678 B13R1.6 CCCCCSc1nccc(n1)N 62a_100000757536_100000210326 [0,1,1,0,0,0|2,0,0]=4 679 B13R1.6 CCCCCSc1nccc(n1)O 62a_100000210326_100011649813 [0,1,1,0,0,0|2,0,0]=4 680 B13R1.6 CCOCCNc1cc(ccn1)F 27a_100011200944_100000764206 [0,1,1,0,0,0|2,0,0]=4 681 B13R1.6 CCOCCNc1cccc(n1)F 27a_100011200944_100009815982 [0,1,1,0,0,0|2,0,0]=4 682 B13R1.6 CCOCCNc1cccc(n1)F 34a_200011432718_100000210202 [0,1,1,0,0,0|2,0,0]=4 683 B13R1.6 CCOCCNc1nccc(n1)C 27a_100011200944_100000750684 [0,1,1,0,0,0|1,0,0]=3 684 B13R1.6 CCOCCNc1nccc(n1)N 27a_100011200944_100000757536 [0,1,1,0,0,0|1,0,0]=3 685 B13R1.6 CCOCCNc1nccc(n1)O 27a_100011200944_100011649813 [0,1,1,0,0,0|1,0,0]=3 686 B13R1.6 CCOCCNc1ncnc(n1)N 27a_100011200944_100000123831 [0,1,1,0,0,0|2,0,0]=4 687 B13R1.6 CCOCCSc1nccc(n1)C 62a_100000210147_100011243806 [0,1,1,0,0,0|2,0,0]=4 688 B13R1.6 CCOCCSc1nccc(n1)C 62a_100011243806_100011215890 [0,1,1,0,0,0|2,0,0]=4 689 B13R1.6 CCOCCSc1nccc(n1)N 62a_100000210147_100000757536 [0,1,1,0,0,0|2,0,0]=4 690 B13R1.6 CCOCCSc1nccc(n1)N 62a_100000757536_100011215890 [0,1,1,0,0,0|2,0,0]=4 691 B13R1.6 CCOCCSc1nccc(n1)O 62a_100000210147_100011649813 [0,1,1,0,0,0|2,0,0]=4 692 B13R1.6 CCSCCNc1cc(ccn1)F 27a_100000106463_100000764206 [0,1,1,0,0,0|2,0,0]=4 693 B13R1.6 CCSCCNc1cccc(n1)F 27a_100000106463_100009815982 [0,1,1,0,0,0|2,0,0]=4 694 B13R1.6 CCSCCNc1nccc(n1)C 27a_100000106463_100000750684 [0,1,1,0,0,0|1,0,0]=3 695 B13R1.6 CCSCCNc1nccc(n1)N 27a_100000106463_100000757536 [0,1,1,0,0,0|1,0,0]=3 696 B13R1.6 CCSCCNc1nccc(n1)O 27a_100000106463_100011649813 [0,1,1,0,0,0|1,0,0]=3 697 B13R1.6 CCSCCNc1ncnc(n1)N 27a_100000106463_100000123831 [0,1,1,0,0,0|2,0,0]=4 698 B13R1.6 CCSCCSc1nccc(n1)C 62a_100000757381_100011243806 [0,1,1,0,0,0|2,0,0]=4 699 B13R1.6 CCSCCSc1nccc(n1)C 62a_100011243806_100000757381 [0,1,1,0,0,0|2,0,0]=4 700 B13R1.6 CCSCCSc1nccc(n1)N 62a_100000757381_100000757536 [0,1,1,0,0,0|2,0,0]=4 701 B13R1.6 CCSCCSc1nccc(n1)N 62a_100000757536_100000757381 [0,1,1,0,0,0|2,0,0]=4 702 B13R1.6 CCSCCSc1nccc(n1)O 62a_100000757381_100011649813 [0,1,1,0,0,0|2,0,0]=4 703 B13R1.6 COCCCNc1nccc(n1)C 27a_100150723488_100000750684 [0,1,1,0,0,0|2,0,0]=4 704 B13R1.6 COCCCNc1nccc(n1)N 27a_100150723488_100000757536 [0,1,1,0,0,0|2,0,0]=4 705 B13R1.6 COCCCNc1nccc(n1)O 27a_100150723488_100011649813 [0,1,1,0,0,0|2,0,0]=4 706 B13R1.6 CSCCCNc1nccc(n1)C 27a_100000749238_100000750684 [0,1,1,0,0,0|2,0,0]=4 707 B13R1.6 CSCCCNc1nccc(n1)N 27a_100000749238_100000757536 [0,1,1,0,0,0|2,0,0]=4 708 B13R1.6 CSCCCNc1nccc(n1)O 27a_100000749238_100011649813 [0,1,1,0,0,0|2,0,0]=4 709 B13R1.6 Cc1ccnc(n1)NCCCCO 27a_100000750430_100000750684 [0,1,1,0,0,0|2,0,0]=4 710 B13R1.6 Nc1ccnc(n1)NCCCCO 27a_100000750430_100000757536 [0,1,1,0,0,0|2,0,0]=4 711 B13R1.6 OCCCCNc1nccc(n1)O 27a_100000750430_100011649813 [0,1,1,0,0,0|2,0,0]=4 712 B13R1.9 CCCCCNc1ccc(cn1)Br 27a_100000209983_100000686858 [0,1,1,0,0,0|2,0,0]=4 713 B13R1.9 CCCCCNc1ncc(cn1)Br 27a_100000209983_100000690281 [0,1,1,0,0,0|1,0,0]=3 714 B13R1.9 CCCCCNc1ncc(cn1)C 27a_100000209983_100000061069 [0,1,1,0,0,0|1,0,0]=3 715 B13R1.9 CCCCCNc1ncc(cn1)Cl 27a_100000209983_100011356929 [0,1,1,0,0,0|1,0,0]=3 716 B13R1.9 CCCCCNc1ncc(cn1)F 27a_100000209983_100000685220 [0,1,1,0,0,0|1,0,0]=3 717 B13R1.9 CCCCCOc1ncc(cn1)F 34a_100011934040_100000718602 [0,1,1,0,0,0|2,0,0]=4 718 B13R1.9 CCCCCSc1ncc(cn1)Br 62a_100000210326_100000690281 [0,1,1,0,0,0|2,0,0]=4 719 B13R1.9 CCCCCSc1ncc(cn1)Br 62a_100000690281_100000210326 [0,1,1,0,0,0|2,0,0]=4 720 B13R1.9 CCCCCSc1ncc(cn1)C 62a_100000061069_100000210326 [0,1,1,0,0,0|2,0,0]=4 721 B13R1.9 CCCCCSc1ncc(cn1)C 62a_100000210326_100000061069 [0,1,1,0,0,0|2,0,0]=4 722 B13R1.9 CCCCCSc1ncc(cn1)Cl 62a_100000210326_100011356929 [0,1,1,0,0,0|2,0,0]=4 723 B13R1.9 CCCCCSc1ncc(cn1)Cl 62a_100011356929_100000210326 [0,1,1,0,0,0|2,0,0]=4 724 B13R1.9 CCCCCSc1ncc(cn1)F 62a_100000210326_100000685220 [0,1,1,0,0,0|2,0,0]=4 725 B13R1.9 CCCCCSc1ncc(cn1)F 62a_100000685220_100000210326 [0,1,1,0,0,0|2,0,0]=4 726 B13R1.9 CCCCCSc1ncc(cn1)N 62a_100000068403_100000210326 [0,1,1,0,0,0|2,0,0]=4 727 B13R1.9 CCCCCSc1ncc(cn1)N 62a_100000210326_100000068403 [0,1,1,0,0,0|2,0,0]=4 728 B13R1.9 CCCCCSc1ncc(cn1)O 62a_100000210326_100000092845 [0,1,1,0,0,0|2,0,0]=4 729 B13R1.9 CCCCCSc1ncc(cn1)O 62a_100000730009_100000210326 [0,1,1,0,0,0|2,0,0]=4 730 B13R1.9 CCOCCNc1ccc(cn1)Br 27a_100011200944_100000686858 [0,1,1,0,0,0|2,0,0]=4 731 B13R1.9 CCOCCNc1ncc(cn1)Br 27a_100011200944_100000690281 [0,1,1,0,0,0|1,0,0]=3 732 B13R1.9 CCOCCNc1ncc(cn1)C 27a_100011200944_100000061069 [0,1,1,0,0,0|1,0,0]=3 733 B13R1.9 CCOCCNc1ncc(cn1)Cl 27a_100011200944_100011356929 [0,1,1,0,0,0|1,0,0]=3 734 B13R1.9 CCOCCNc1ncc(cn1)F 27a_100011200944_100000685220 [0,1,1,0,0,0|1,0,0]=3 735 B13R1.9 CCOCCOc1ncc(cn1)F 34a_100011934040_100000210147 [0,1,1,0,0,0|2,0,0]=4 736 B13R1.9 CCOCCSc1ncc(cn1)Br 62a_100000210147_100000690281 [0,1,1,0,0,0|2,0,0]=4 737 B13R1.9 CCOCCSc1ncc(cn1)Br 62a_100000690281_100011215890 [0,1,1,0,0,0|2,0,0]=4 738 B13R1.9 CCOCCSc1ncc(cn1)C 62a_100000061069_100011215890 [0,1,1,0,0,0|2,0,0]=4 739 B13R1.9 CCOCCSc1ncc(cn1)C 62a_100000210147_100000061069 [0,1,1,0,0,0|2,0,0]=4 740 B13R1.9 CCOCCSc1ncc(cn1)Cl 62a_100000210147_100011356929 [0,1,1,0,0,0|2,0,0]=4 741 B13R1.9 CCOCCSc1ncc(cn1)Cl 62a_100011356929_100011215890 [0,1,1,0,0,0|2,0,0]=4 742 B13R1.9 CCOCCSc1ncc(cn1)F 62a_100000210147_100000685220 [0,1,1,0,0,0|2,0,0]=4 743 B13R1.9 CCOCCSc1ncc(cn1)F 62a_100000685220_100011215890 [0,1,1,0,0,0|2,0,0]=4 744 B13R1.9 CCOCCSc1ncc(cn1)N 62a_100000068403_100011215890 [0,1,1,0,0,0|2,0,0]=4 745 B13R1.9 CCOCCSc1ncc(cn1)N 62a_100000210147_100000068403 [0,1,1,0,0,0|2,0,0]=4 746 B13R1.9 CCOCCSc1ncc(cn1)O 62a_100000210147_100000092845 [0,1,1,0,0,0|2,0,0]=4 747 B13R1.9 CCOCCSc1ncc(cn1)O 62a_100000730009_100011215890 [0,1,1,0,0,0|2,0,0]=4 748 B13R1.9 CCSCCNc1ccc(cn1)Br 27a_100000106463_100000686858 [0,1,1,0,0,0|2,0,0]=4 749 B13R1.9 CCSCCNc1ncc(cn1)Br 27a_100000106463_100000690281 [0,1,1,0,0,0|1,0,0]=3 750 B13R1.9 CCSCCNc1ncc(cn1)C 27a_100000106463_100000061069 [0,1,1,0,0,0|1,0,0]=3 751 B13R1.9 CCSCCNc1ncc(cn1)Cl 27a_100000106463_100011356929 [0,1,1,0,0,0|1,0,0]=3 752 B13R1.9 CCSCCNc1ncc(cn1)F 27a_100000106463_100000685220 [0,1,1,0,0,0|1,0,0]=3 753 B13R1.9 CCSCCOc1ncc(cn1)F 34a_100011934040_100000757381 [0,1,1,0,0,0|2,0,0]=4 754 B13R1.9 CCSCCSc1ncc(cn1)Br 62a_100000690281_100000757381 [0,1,1,0,0,0|2,0,0]=4 755 B13R1.9 CCSCCSc1ncc(cn1)Br 62a_100000757381_100000690281 [0,1,1,0,0,0|2,0,0]=4 756 B13R1.9 CCSCCSc1ncc(cn1)C 62a_100000061069_100000757381 [0,1,1,0,0,0|2,0,0]=4 757 B13R1.9 CCSCCSc1ncc(cn1)C 62a_100000757381_100000061069 [0,1,1,0,0,0|2,0,0]=4 758 B13R1.9 CCSCCSc1ncc(cn1)Cl 62a_100000757381_100011356929 [0,1,1,0,0,0|2,0,0]=4 759 B13R1.9 CCSCCSc1ncc(cn1)Cl 62a_100011356929_100000757381 [0,1,1,0,0,0|2,0,0]=4 760 B13R1.9 CCSCCSc1ncc(cn1)F 62a_100000685220_100000757381 [0,1,1,0,0,0|2,0,0]=4 761 B13R1.9 CCSCCSc1ncc(cn1)F 62a_100000757381_100000685220 [0,1,1,0,0,0|2,0,0]=4 762 B13R1.9 CCSCCSc1ncc(cn1)N 62a_100000068403_100000757381 [0,1,1,0,0,0|2,0,0]=4 763 B13R1.9 CCSCCSc1ncc(cn1)N 62a_100000757381_100000068403 [0,1,1,0,0,0|2,0,0]=4 764 B13R1.9 CCSCCSc1ncc(cn1)O 62a_100000730009_100000757381 [0,1,1,0,0,0|2,0,0]=4 765 B13R1.9 CCSCCSc1ncc(cn1)O 62a_100000757381_100000092845 [0,1,1,0,0,0|2,0,0]=4 766 B13R1.9 COCCCNc1ncc(cn1)Br 27a_100150723488_100000690281 [0,1,1,0,0,0|2,0,0]=4 767 B13R1.9 COCCCNc1ncc(cn1)C 27a_100150723488_100000061069 [0,1,1,0,0,0|2,0,0]=4 768 B13R1.9 COCCCNc1ncc(cn1)Cl 27a_100150723488_100011356929 [0,1,1,0,0,0|2,0,0]=4 769 B13R1.9 COCCCNc1ncc(cn1)F 27a_100150723488_100000685220 [0,1,1,0,0,0|2,0,0]=4 770 B13R1.9 CSCCCNc1ncc(cn1)Br 27a_100000749238_100000690281 [0,1,1,0,0,0|2,0,0]=4 771 B13R1.9 CSCCCNc1ncc(cn1)C 27a_100000749238_100000061069 [0,1,1,0,0,0|2,0,0]=4 772 B13R1.9 CSCCCNc1ncc(cn1)Cl 27a_100000749238_100011356929 [0,1,1,0,0,0|2,0,0]=4 773 B13R1.9 CSCCCNc1ncc(cn1)F 27a_100000749238_100000685220 [0,1,1,0,0,0|2,0,0]=4 774 B13R1.9 Cc1cnc(nc1)NCCCCO 27a_100000750430_100000061069 [0,1,1,0,0,0|2,0,0]=4 775 B13R1.9 OCCCCNc1ncc(cn1)Br 27a_100000750430_100000690281 [0,1,1,0,0,0|2,0,0]=4 776 B13R1.9 OCCCCNc1ncc(cn1)Cl 27a_100000750430_100011356929 [0,1,1,0,0,0|2,0,0]=4 777 B13R1.9 OCCCCNc1ncc(cn1)F 27a_100000750430_100000685220 [0,1,1,0,0,0|2,0,0]=4 778 B13R1.24 CCCCCN(C)c1ncccn1 27a_100000223495_100000211032 [0,1,1,0,0,0|1,0,0]=3 779 B13R1.24 CN(CCCCO)c1ncccn1 27a_100000717598_100000211032 [0,1,1,0,0,0|2,0,0]=4 780 B13R1.24 COCCCN(C)c1ncccn1 27a_100000224831_100000211032 [0,1,1,0,0,0|2,0,0]=4 781 B13R1.28 C#CCCCCNc1ncccn1 27a_100000706060_100000211032 [0,1,1,0,0,0|1,0,1]=4 782 B13R1.28 C#CCOCCNc1ncccn1 27a_100000700922_100000211032 [0,1,1,0,0,0|1,0,1]=4 783 B13R1.28 C=CCCCCNc1ncccn1 27a_100000703577_100000211032 [0,1,1,0,0,0|1,0,1]=4 784 B13R1.28 CC/C=C\CCSc1ncccn1 62a_100000211032_100015370543 [0,1,1,0,0,0|2,0,0]=4 785 B13R1.28 CC/C=C\CCSc1ncccn1 62a_100015370543_100000211032 [0,1,1,0,0,0|2,0,0]=4 786 B13R1.28 CCCCC=NNc1ncccn1 4a_100000736892_100000210104 [0,1,1,0,0,0|1,0,1]=4 787 B13R1.28 CCCCCC=Cc1ncccn1 271570a_100000062253_100000211032 [0,1,1,0,0,0|2,0,0]=4 788 B13R1.28 CCCCCCNc1ncccn1 27a_100000210581_100000211032 [0,1,1,0,0,0|1,0,0]=3 789 B13R1.28 CCCCCCSc1ncccn1 62a_100000210314_100000211032 [0,1,1,0,0,0|2,0,0]=4 790 B13R1.28 CCCCCCSc1ncccn1 62a_100000211032_100000210757 [0,1,1,0,0,0|2,0,0]=4 791 B13R1.28 CCCCCNCc1ccccn1 207a_100000209983_100000209966 [0,1,1,0,0,0|2,0,0]=4 792 B13R1.28 CCCCCNCc1ccccn1 2230a_100000209983_100000721315 [0,1,1,0,0,0|2,0,0]=4 793 B13R1.28 CCCCCNCc1ccccn1 270004a_100000209983_100000209966 [0,1,1,0,0,0|2,0,0]=4 794 B13R1.28 CCCCCNCc1ncccn1 2230a_100000209983_100000703007 [0,1,1,0,0,0|1,0,0]=3 795 B13R1.28 CCCCCNCc1ncccn1 270004a_100000209983_100011532527 [0,1,1,0,0,0|1,0,0]=3 796 B13R1.28 CCCCCOCc1ncccn1 34a_100000210253_100000703007 [0,1,1,0,0,0|2,0,0]=4 797 B13R1.28 CCCCCOCc1ncccn1 7a_100000210253_100000703007 [0,1,1,0,0,0|2,0,0]=4 798 B13R1.28 CCCCCSCc1ncccn1 62a_100000210326_100000703007 [0,1,1,0,0,0|2,0,0]=4 799 B13R1.28 CCCCCSCc1ncccn1 62a_100000703007_100000210326 [0,1,1,0,0,0|2,0,0]=4 800 B13R1.28 CCCCOCSc1ncccn1 62a_100000211032_100011995733 [0,1,1,0,0,0|2,0,0]=4 801 B13R1.28 CCCCOCSc1ncccn1 62a_100011995733_100000211032 [0,1,1,0,0,0|2,0,0]=4 802 B13R1.28 CCCNCCOc1ccccn1 2230a_106741647558_100000210303 [0,1,1,0,0,0|2,0,0]=4 803 B13R1.28 CCCOCCNc1ncccn1 27a_100161115042_100000211032 [0,1,1,0,0,0|1,0,0]=3 804 B13R1.28 CCCOCCSc1ncccn1 62a_100000211032_100011215938 [0,1,1,0,0,0|2,0,0]=4 805 B13R1.28 CCCOCCSc1ncccn1 62a_100011215938_100000211032 [0,1,1,0,0,0|2,0,0]=4 806 B13R1.28 CCCSCCNc1ncccn1 27a_100020603323_100000211032 [0,1,1,0,0,0|1,0,0]=3 807 B13R1.28 CCNCCSSc1ccccn1 2230a_100016995281_100000210202 [0,1,1,0,0,0|2,0,0]=4 808 B13R1.28 CCNCCSSc1ccccn1 7a_100016995281_100000210202 [0,1,1,0,0,0|2,0,0]=4 809 B13R1.28 CCOCCCNc1ncccn1 27a_100000210961_100000211032 [0,1,1,0,0,0|1,0,0]=3 810 B13R1.28 CCOCCCSc1ncccn1 62a_100000211032_100012232248 [0,1,1,0,0,0|2,0,0]=4 811 B13R1.28 CCOCCCSc1ncccn1 62a_100012232248_100000211032 [0,1,1,0,0,0|2,0,0]=4 812 B13R1.28 CCOCCNCc1ccccn1 207a_100011200944_100000209966 [0,1,1,0,0,0|2,0,0]=4 813 B13R1.28 CCOCCNCc1ccccn1 2230a_102516460346_100000721315 [0,1,1,0,0,0|2,0,0]=4 814 B13R1.28 CCOCCNCc1ccccn1 270004a_102516460346_100000209966 [0,1,1,0,0,0|2,0,0]=4 815 B13R1.28 CCOCCNCc1ccccn1 34a_102516460346_100000721315 [0,1,1,0,0,0|2,0,0]=4 816 B13R1.28 CCOCCNCc1ncccn1 2230a_102516460346_100000703007 [0,1,1,0,0,0|1,0,0]=3 817 B13R1.28 CCOCCNCc1ncccn1 270004a_102516460346_100011532527 [0,1,1,0,0,0|1,0,0]=3 818 B13R1.28 CCOCCNCc1ncccn1 34a_102516460346_100000703007 [0,1,1,0,0,0|1,0,0]=3 819 B13R1.28 CCOCCOCc1ncccn1 34a_100000210136_100000703007 [0,1,1,0,0,0|2,0,0]=4 820 B13R1.28 CCOCCOCc1ncccn1 7a_100000210136_100000703007 [0,1,1,0,0,0|2,0,0]=4 821 B13R1.28 CCOCCSCc1ncccn1 62a_100000210147_100000703007 [0,1,1,0,0,0|2,0,0]=4 822 B13R1.28 CCOCCSCc1ncccn1 62a_100000703007_100011215890 [0,1,1,0,0,0|2,0,0]=4 823 B13R1.28 CCSCCNCc1ccccn1 207a_100000106463_100000209966 [0,1,1,0,0,0|2,0,0]=4 824 B13R1.28 CCSCCNCc1ccccn1 2230a_100000106463_100000721315 [0,1,1,0,0,0|2,0,0]=4 825 B13R1.28 CCSCCNCc1ccccn1 270004a_100000106463_100000209966 [0,1,1,0,0,0|2,0,0]=4 826 B13R1.28 CCSCCNCc1ncccn1 2230a_100000106463_100000703007 [0,1,1,0,0,0|1,0,0]=3 827 B13R1.28 CCSCCNCc1ncccn1 270004a_100000106463_100011532527 [0,1,1,0,0,0|1,0,0]=3 828 B13R1.28 CCSCCOCc1ncccn1 34a_100000212035_100000703007 [0,1,1,0,0,0|2,0,0]=4 829 B13R1.28 CCSCCOCc1ncccn1 7a_100000212035_100000703007 [0,1,1,0,0,0|2,0,0]=4 830 B13R1.28 CCSCCSCc1ncccn1 62a_100000703007_100000757381 [0,1,1,0,0,0|2,0,0]=4 831 B13R1.28 CCSCCSCc1ncccn1 62a_100000757381_100000703007 [0,1,1,0,0,0|2,0,0]=4 832 B13R1.28 COCCCCSc1ncccn1 62a_100000211032_100000730899 [0,1,1,0,0,0|2,0,0]=4 833 B13R1.28 COCCCCSc1ncccn1 62a_100000730899_100000211032 [0,1,1,0,0,0|2,0,0]=4 834 B13R1.28 COCCCNCc1ncccn1 270004a_100150723488_100011532527 [0,1,1,0,0,0|2,0,0]=4 835 B13R1.28 COCCCNCc1ncccn1 34a_100150723488_100000703007 [0,1,1,0,0,0|2,0,0]=4 836 B13R1.28 COCNCCOc1ccccn1 2230a_106741647558_100000766300 [0,1,1,0,0,0|2,0,0]=4 837 B13R1.28 CSCCCNCc1ncccn1 2230a_100000749238_100000703007 [0,1,1,0,0,0|2,0,0]=4 838 B13R1.28 CSCCCNCc1ncccn1 270004a_100000749238_100011532527 [0,1,1,0,0,0|2,0,0]=4 839 B13R1.28 CSCNCCOc1ccccn1 2230a_106741647558_100011218213 [0,1,1,0,0,0|2,0,0]=4 840 B13R1.28 FCCCCCSc1ncccn1 62a_100000211032_100000729378 [0,1,1,0,0,0|2,0,0]=4 841 B13R1.28 FCCCCCSc1ncccn1 62a_100000729378_100000211032 [0,1,1,0,0,0|2,0,0]=4 842 B13R1.28 FCCNCCOc1ccccn1 2230a_106741647558_100011217306 [0,1,1,0,0,0|2,0,0]=4 843 B13R1.28 N#CCCCCNc1ncccn1 27a_100000751965_100000211032 [0,1,1,0,0,0|1,0,1]=4 844 B13R1.28 OCCCCCNc1ncccn1 27a_100000762737_100000211032 [0,1,1,0,0,0|1,0,0]=3 845 B13R1.28 OCCCCCSc1ncccn1 62a_100000211032_100000746330 [0,1,1,0,0,0|2,0,0]=4 846 B13R1.28 OCCCCCSc1ncccn1 62a_100000746330_100000211032 [0,1,1,0,0,0|2,0,0]=4 847 B13R1.28 OCCCCNCc1ncccn1 2230a_100000750430_100000703007 [0,1,1,0,0,0|2,0,0]=4 848 B13R1.28 OCCCCNCc1ncccn1 270004a_100000750430_100011532527 [0,1,1,0,0,0|2,0,0]=4 849 B13R1.28 OCCCCNCc1ncccn1 34a_100000750430_100000703007 [0,1,1,0,0,0|2,0,0]=4 850 B13R1.28 OCCNCCOc1ccccn1 2230a_106741647558_100000211926 [0,1,1,0,0,0|2,0,0]=4 851 B13R1.28 OCCOCCNc1ncccn1 27a_100000211614_100000211032 [0,1,1,0,0,0|1,0,0]=3 852 B13R1.28 OCCOCCSc1ncccn1 62a_100000211032_100011215305 [0,1,1,0,0,0|2,0,0]=4 853 B13R1.28 OCCOCCSc1ncccn1 62a_100011215305_100000211032 [0,1,1,0,0,0|2,0,0]=4 854 B13R1.28 OCCSCCNc1ncccn1 27a_100011219999_100000211032 [0,1,1,0,0,0|1,0,0]=3 855 B13R1.42 CCCC(C)CSc1ncccn1 62a_100000211032_100011216630 [0,1,1,0,0,0|2,0,0]=4 856 B13R1.42 CCCC(C)CSc1ncccn1 62a_100011216630_100000211032 [0,1,1,0,0,0|2,0,0]=4 857 B13R1.42 CCNC(=O)CNc1ncccn1 27a_100016988866_100000211032 [0,1,1,0,0,0|0,0,1]=3 858 B13R1.42 CCNC(=O)CSc1ncccn1 240690a_100015525214_200000156282 [0,1,1,0,0,0|1,0,1]=4 859 B13R1.42 CCNC(=O)CSc1ncccn1 62a_100000183381_100000211032 [0,1,1,0,0,0|1,0,1]=4 860 B13R1.42 CCNC(=O)CSc1ncccn1 62a_100000211032_100000183381 [0,1,1,0,0,0|1,0,1]=4 861 B13R1.42 CCNC(=O)NNc1ncccn1 273464a_100015525214_100000736892 [0,1,1,0,0,0|1,0,1]=4 862 B13R1.42 CCNC(=O)NNc1ncccn1 512a_100015525214_100000736892 [0,1,1,0,0,0|1,0,1]=4 863 B13R1.42 COCC(O)CNc1ncccn1 27a_100000756049_100000211032 [0,1,1,0,0,0|2,0,0]=4 864 B13R1.44 CCCCC(C)Nc1ncccn1 27a_100000126638_100000211032 [0,1,1,0,0,0|1,0,0]=3 865 B13R1.44 CCCCC(C)Sc1ncccn1 62a_100000211032_200011215066 [0,1,1,0,0,0|2,0,0]=4 866 B13R1.44 CCCCC(C)Sc1ncccn1 62a_200011215066_100000211032 [0,1,1,0,0,0|2,0,0]=4 867 B13R1.44 CCNCC(=O)Nc1ccccn1 2230a_100015525214_100020662008 [0,1,1,0,0,0|1,0,1]=4 868 B13R1.44 CCSCC(=O)Nc1ncccn1 62a_100000183248_100000210202 [0,1,1,0,0,0|1,0,1]=4 869 B13R1.44 CCSCC(=O)Nc1ncccn1 62a_100000210202_100000183248 [0,1,1,0,0,0|1,0,1]=4 870 B13R1.337 CC(=O)NCCNc1ncccn1 27a_100000209853_100000211032 [0,1,1,0,0,0|0,0,1]=3 871 B13R1.337 CC(=O)NCCSc1ncccn1 62a_100000189650_100000211032 [0,1,1,0,0,0|1,0,1]=4 872 B13R1.337 CC(=O)NCCSc1ncccn1 62a_100000211032_100000189650 [0,1,1,0,0,0|1,0,1]=4 873 B13R1.337 CC(C)CCCNc1ncccn1 27a_200000737386_100000211032 [0,1,1,0,0,0|1,0,0]=3 874 B13R1.337 CC(C)CCCSc1ncccn1 62a_100000211032_100011214892 [0,1,1,0,0,0|2,0,0]=4 875 B13R1.337 CC(C)CCCSc1ncccn1 62a_100011214892_100000211032 [0,1,1,0,0,0|2,0,0]=4 876 B13R1.337 CC(C)NCCOc1ccccn1 2230a_106741647558_100000210206 [0,1,1,0,0,0|2,0,0]=4 877 B13R1.337 CC(C)OCCNc1ncccn1 27a_100000701111_100000211032 [0,1,1,0,0,0|1,0,0]=3 878 B13R1.337 CC(C)OCCSc1ncccn1 62a_100000211032_100000211751 [0,1,1,0,0,0|2,0,0]=4 879 B13R1.337 CC(C)OCCSc1ncccn1 62a_100000211751_100000211032 [0,1,1,0,0,0|2,0,0]=4 880 B13R1.337 CC(C)SCCNc1ncccn1 27a_100000731138_100000211032 [0,1,1,0,0,0|1,0,0]=3 881 B13R1.337 CC(C)SCCSc1ncccn1 62a_100000211032_100000730970 [0,1,1,0,0,0|2,0,0]=4 882 B13R1.337 CC(C)SCCSc1ncccn1 62a_100000730970_100000211032 [0,1,1,0,0,0|2,0,0]=4 883 B13R1.337 CC(O)CCCSc1ncccn1 62a_100000211032_200000718107 [0,1,1,0,0,0|2,0,0]=4 884 B13R1.337 CC(O)CCCSc1ncccn1 62a_200000718107_100000211032 [0,1,1,0,0,0|2,0,0]=4 885 B13R1.337 CN(C)CCCNc1ncccn1 27a_102531767803_100000211032 [0,1,1,0,0,0|2,0,0]=4 886 B13R1.337 CS(=O)CCCNc1ncccn1 27a_200000753449_100000211032 [0,1,1,0,0,0|2,0,0]=4 887 B13R1.337 NC(=O)NCCNc1ncccn1 27a_100020590234_100000211032 [0,1,1,0,0,0|1,0,1]=4 888 B13R1.555 CCCCCNc1ncccc1Br 27a_100000209983_100000696092 [0,1,1,0,0,0|2,0,0]=4 889 B13R1.555 CCOCCNc1ncccc1Br 27a_100011200944_100000696092 [0,1,1,0,0,0|2,0,0]=4 890 B13R1.555 CCSCCNc1ncccc1Br 27a_100000106463_100000696092 [0,1,1,0,0,0|2,0,0]=4 891 B13R1.718 CC(CO)CCNc1ncccn1 27a_106354213184_100000211032 [0,1,1,0,0,0|2,0,0]=4 892 B13R1.718 CCC(C)CCNc1ncccn1 27a_100020591266_100000211032 [0,1,1,0,0,0|1,0,0]=3 893 B13R1.718 CNC(=O)CCNc1ncccn1 27a_100000738227_100000211032 [0,1,1,0,0,0|2,0,0]=4 894 B13R1.11 CCC(=O)CN(C)c1ncccn1 1458a_200000737684_100000210202 [0,1,1,0,0,0|1,0,1]=4 895 B13R1.11 CCC(C)CN(C)c1ncccn1 27a_100000753921_100000211032 [0,1,1,0,0,0|1,0,0]=3 896 B13R1.11 CN(CC(O)CO)c1ncccn1 27a_100011216503_100000211032 [0,1,1,0,0,0|2,0,0]=4 897 B13R1.11 CNC(=O)CN(C)c1ncccn1 1626a_100102657272_200000737684 [0,1,1,0,0,0|0,0,1]=3 898 B13R1.11 CNC(=O)CN(C)c1ncccn1 240690a_100102657272_200000737684 [0,1,1,0,0,0|0,0,1]=3 899 B13R1.11 CNC(=O)CN(C)c1ncccn1 27a_100000189611_100000211032 [0,1,1,0,0,0|0,0,1]=3 900 B13R1.11 COC(=O)CN(C)c1ncccn1 27a_100000198492_100000211032 [0,1,1,0,0,0|1,0,1]=4 901 B13R1.17 C=CCCN(C)c1ncc(cn1)Br 27a_100020639649_100000690281 [0,1,1,0,0,0|1,0,1]=4 902 B13R1.17 C=CCCN(C)c1ncc(cn1)C 27a_100020639649_100000061069 [0,1,1,0,0,0|1,0,1]=4 903 B13R1.17 C=CCCN(C)c1ncc(cn1)Cl 27a_100020639649_100011356929 [0,1,1,0,0,0|1,0,1]=4 904 B13R1.17 C=CCCN(C)c1ncc(cn1)F 27a_100020639649_100000685220 [0,1,1,0,0,0|1,0,1]=4 905 B13R1.17 CCCCN(C)c1ccc(cn1)Br 27a_100000207549_100000686858 [0,1,1,0,0,0|2,0,0]=4 906 B13R1.17 CCCCN(C)c1ncc(cn1)Br 27a_100000207549_100000690281 [0,1,1,0,0,0|1,0,0]=3 907 B13R1.17 CCCCN(C)c1ncc(cn1)C 27a_100000207549_100000061069 [0,1,1,0,0,0|1,0,0]=3 908 B13R1.17 CCCCN(C)c1ncc(cn1)Cl 27a_100000207549_100011356929 [0,1,1,0,0,0|1,0,0]=3 909 B13R1.17 CCCCN(C)c1ncc(cn1)F 27a_100000207549_100000685220 [0,1,1,0,0,0|1,0,0]=3 910 B13R1.17 CCCCN(C)c1ncc(cn1)O 271570a_203496583355_100011939186 [0,1,1,0,0,0|1,0,0]=3 911 B13R1.17 CN(CCC#N)c1ncc(cn1)Br 27a_100000184479_100000690281 [0,1,1,0,0,0|2,0,0]=4 912 B13R1.17 CN(CCC#N)c1ncc(cn1)Cl 27a_100000184479_100011356929 [0,1,1,0,0,0|2,0,0]=4 913 B13R1.17 CN(CCC#N)c1ncc(cn1)F 27a_100000184479_100000685220 [0,1,1,0,0,0|2,0,0]=4 914 B13R1.17 CN(CCCO)c1ncc(cn1)Br 27a_100000213112_100000690281 [0,1,1,0,0,0|2,0,0]=4 915 B13R1.17 CN(CCCO)c1ncc(cn1)Cl 27a_100000213112_100011356929 [0,1,1,0,0,0|2,0,0]=4 916 B13R1.17 CN(CCCO)c1ncc(cn1)F 27a_100000213112_100000685220 [0,1,1,0,0,0|2,0,0]=4 917 B13R1.17 COCCN(C)c1ccc(cn1)Br 27a_100000743101_100000686858 [0,1,1,0,0,0|2,0,0]=4 918 B13R1.17 COCCN(C)c1ncc(cn1)Br 27a_100000743101_100000690281 [0,1,1,0,0,0|1,0,0]=3 919 B13R1.17 COCCN(C)c1ncc(cn1)C 27a_100000743101_100000061069 [0,1,1,0,0,0|1,0,0]=3 920 B13R1.17 COCCN(C)c1ncc(cn1)Cl 27a_100000743101_100011356929 [0,1,1,0,0,0|1,0,0]=3 921 B13R1.17 COCCN(C)c1ncc(cn1)F 27a_100000743101_100000685220 [0,1,1,0,0,0|1,0,0]=3 922 B13R1.17 COCCN(C)c1ncc(cn1)O 271570a_203496583355_100011939273 [0,1,1,0,0,0|1,0,0]=3 923 B13R1.17 CSCCN(C)c1ccc(cn1)Br 27a_100000686725_100000686858 [0,1,1,0,0,0|2,0,0]=4 924 B13R1.17 CSCCN(C)c1ncc(cn1)Br 27a_100000686725_100000690281 [0,1,1,0,0,0|1,0,0]=3 925 B13R1.17 CSCCN(C)c1ncc(cn1)C 27a_100000686725_100000061069 [0,1,1,0,0,0|1,0,0]=3 926 B13R1.17 CSCCN(C)c1ncc(cn1)Cl 27a_100000686725_100011356929 [0,1,1,0,0,0|1,0,0]=3 927 B13R1.17 CSCCN(C)c1ncc(cn1)F 27a_100000686725_100000685220 [0,1,1,0,0,0|1,0,0]=3 928 B13R1.17 Cc1cnc(nc1)N(C)CCC#N 27a_100000184479_100000061069 [0,1,1,0,0,0|2,0,0]=4 929 B13R1.17 Cc1cnc(nc1)N(C)CCCO 27a_100000213112_100000061069 [0,1,1,0,0,0|2,0,0]=4 930 B13R1.18 C=CCCN(C)c1nccc(n1)C 27a_100020639649_100000750684 [0,1,1,0,0,0|1,0,1]=4 931 B13R1.18 C=CCCN(C)c1nccc(n1)N 27a_100020639649_100000757536 [0,1,1,0,0,0|1,0,1]=4 932 B13R1.18 C=CCCN(C)c1nccc(n1)O 27a_100020639649_100011649813 [0,1,1,0,0,0|1,0,1]=4 933 B13R1.18 CCCCN(C)c1cc(ccn1)F 27a_100000207549_100000764206 [0,1,1,0,0,0|2,0,0]=4 934 B13R1.18 CCCCN(C)c1cccc(n1)F 27a_100000207549_100009815982 [0,1,1,0,0,0|2,0,0]=4 935 B13R1.18 CCCCN(C)c1nccc(n1)C 27a_100000207549_100000750684 [0,1,1,0,0,0|1,0,0]=3 936 B13R1.18 CCCCN(C)c1nccc(n1)N 27a_100000207549_100000757536 [0,1,1,0,0,0|1,0,0]=3 937 B13R1.18 CCCCN(C)c1nccc(n1)O 27a_100000207549_100011649813 [0,1,1,0,0,0|1,0,0]=3 938 B13R1.18 CCCCN(C)c1ncnc(n1)N 27a_100000207549_100000123831 [0,1,1,0,0,0|2,0,0]=4 939 B13R1.18 CN(CCC#N)c1nccc(n1)N 27a_100000184479_100000757536 [0,1,1,0,0,0|2,0,0]=4 940 B13R1.18 CN(CCC#N)c1nccc(n1)O 27a_100000184479_100011649813 [0,1,1,0,0,0|2,0,0]=4 941 B13R1.18 CN(CCCO)c1nccc(n1)N 27a_100000213112_100000757536 [0,1,1,0,0,0|2,0,0]=4 942 B13R1.18 CN(CCCO)c1nccc(n1)O 27a_100000213112_100011649813 [0,1,1,0,0,0|2,0,0]=4 943 B13R1.18 COCCN(C)c1cc(ccn1)F 27a_100000743101_100000764206 [0,1,1,0,0,0|2,0,0]=4 944 B13R1.18 COCCN(C)c1cccc(n1)F 27a_100000743101_100009815982 [0,1,1,0,0,0|2,0,0]=4 945 B13R1.18 COCCN(C)c1nccc(n1)C 27a_100000743101_100000750684 [0,1,1,0,0,0|1,0,0]=3 946 B13R1.18 COCCN(C)c1nccc(n1)N 27a_100000743101_100000757536 [0,1,1,0,0,0|1,0,0]=3 947 B13R1.18 COCCN(C)c1nccc(n1)O 27a_100000743101_100011649813 [0,1,1,0,0,0|1,0,0]=3 948 B13R1.18 COCCN(C)c1ncnc(n1)N 27a_100000743101_100000123831 [0,1,1,0,0,0|2,0,0]=4 949 B13R1.18 CSCCN(C)c1cc(ccn1)F 27a_100000686725_100000764206 [0,1,1,0,0,0|2,0,0]=4 950 B13R1.18 CSCCN(C)c1cccc(n1)F 27a_100000686725_100009815982 [0,1,1,0,0,0|2,0,0]=4 951 B13R1.18 CSCCN(C)c1nccc(n1)C 27a_100000686725_100000750684 [0,1,1,0,0,0|1,0,0]=3 952 B13R1.18 CSCCN(C)c1nccc(n1)N 27a_100000686725_100000757536 [0,1,1,0,0,0|1,0,0]=3 953 B13R1.18 CSCCN(C)c1nccc(n1)O 27a_100000686725_100011649813 [0,1,1,0,0,0|1,0,0]=3 954 B13R1.18 CSCCN(C)c1ncnc(n1)N 27a_100000686725_100000123831 [0,1,1,0,0,0|2,0,0]=4 955 B13R1.18 Cc1ccnc(n1)N(C)CCC#N 27a_100000184479_100000750684 [0,1,1,0,0,0|2,0,0]=4 956 B13R1.18 Cc1ccnc(n1)N(C)CCCO 27a_100000213112_100000750684 [0,1,1,0,0,0|2,0,0]=4 957 B13R1.45 CC(C)CCN(C)c1ncccn1 27a_100000742789_100000211032 [0,1,1,0,0,0|1,0,0]=3 958 B13R1.45 CN(C)CCN(C)c1ccccc1 2230a_106657271745_200000210301 [0,1,1,0,0,0|2,0,0]=4 959 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_100000210012_100000755713 [0,1,1,0,0,0|2,0,0]=4 960 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_106657271745_200000210301 [0,1,1,0,0,0|2,0,0]=4 961 B13R1.45 CN(C)CCN(C)c1ccccc1 269982a_200000219566_200000210301 [0,1,1,0,0,0|2,0,0]=4 962 B13R1.45 CN(C)CCN(C)c1cccnn1 27a_100000225618_100016991348 [0,1,1,0,0,0|2,0,0]=4 963 B13R1.45 CN(C)CCN(C)c1ccncn1 27a_100000225618_100000703185 [0,1,1,0,0,0|2,0,0]=4 964 B13R1.45 CN(C)CCN(C)c1cnccn1 27a_100000225618_100000211759 [0,1,1,0,0,0|2,0,0]=4 965 B13R1.45 CN(C)CCN(C)c1ncccn1 27a_100000225618_100000211032 [0,1,1,0,0,0|0,0,0]=2 966 B13R1.45 CN(C)CCN([13CH3])c1ccccc1 269982a_200000219566_200025704644 [0,1,1,0,0,0|2,0,0]=4 967 B13R1.45 CN(CCC(=O)N)c1ncccn1 27a_100000730477_100000211032 [0,1,1,0,0,0|2,0,0]=4 968 B13R1.45 CN([13CH3])CCN(C)c1ccccc1 2230a_106657271745_200025704644 [0,1,1,0,0,0|2,0,0]=4 969 B13R1.45 CN([13CH3])CCN(C)c1ccccc1 269982a_106657271745_200025704644 [0,1,1,0,0,0|2,0,0]=4 970 B13R1.47 CC(CCO)N(C)c1ncccn1 27a_100000731037_100000211032 [0,1,1,0,0,0|2,0,0]=4 971 B13R1.47 CC(CN[13CH3])N(C)c1ccccc1 2230a_100000245588_200025704644 [0,1,1,0,0,0|2,0,0]=4 972 B13R1.47 CNCC(C)N(C)c1ccccc1 2230a_100000245588_200000210301 [0,1,1,0,0,0|2,0,0]=4 973 B13R1.674 CCCCN(C)c1ncccc1Br 27a_100000207549_100000696092 [0,1,1,0,0,0|2,0,0]=4 974 B13R1.674 COCCN(C)c1ncccc1Br 27a_100000743101_100000696092 [0,1,1,0,0,0|2,0,0]=4 975 B13R1.674 CSCCN(C)c1ncccc1Br 27a_100000686725_100000696092 [0,1,1,0,0,0|2,0,0]=4 976 B13R2.10 CN1CCC(C1)c2ccccn2 2230a_100102730755_200000210301 [0,1,0,0,1,0|2,0,0]=4 977 B13R2.10 CN1CCC(C1)c2ccccn2 269982a_100102730755_200000210301 [0,1,0,0,1,0|2,0,0]=4 978 B13R2.10 C[C@@H]1CCN(C1)c2cccnn2 27a_100016987628_100016991348 [0,1,0,0,1,0|2,0,0]=4 979 B13R2.10 C[C@@H]1CCN(C1)c2ccncn2 27a_100016987628_100000703185 [0,1,0,0,1,0|2,0,0]=4 980 B13R2.10 C[C@@H]1CCN(C1)c2cnccn2 27a_100016987628_100000211759 [0,1,0,0,1,0|2,0,0]=4 981 B13R2.10 C[C@@H]1CCN(C1)c2ncccn2 27a_100016987628_100000211032 [0,1,0,0,1,0|0,0,0]=2 982 B13R2.10 Cc1nc(no1)N2CCOCC2 270196a_100011217613_100000070787 [0,1,0,0,1,0|2,0,0]=4 983 B13R2.10 Cc1nc(no1)N2CCOCC2 27a_100015191051_100012003639 [0,1,0,0,1,0|2,0,0]=4 984 B13R2.10 Cc1nc(no1)N2CCSCC2 27a_100000737611_100012003639 [0,1,0,0,1,0|2,0,0]=4 985 B13R2.10 F[C@H]1CCN(C1)c2cccnn2 27a_100015203821_100016991348 [0,1,0,0,1,0|2,0,0]=4 986 B13R2.10 F[C@H]1CCN(C1)c2ccncn2 27a_100015203821_100000703185 [0,1,0,0,1,0|2,0,0]=4 987 B13R2.10 F[C@H]1CCN(C1)c2cnccn2 27a_100015203821_100000211759 [0,1,0,0,1,0|2,0,0]=4 988 B13R2.10 F[C@H]1CCN(C1)c2ncccn2 27a_100015203821_100000211032 [0,1,0,0,1,0|0,0,0]=2 989 B13R2.10 O=C1CN(CN1)c2ncccn2 27a_200000708111_100000211032 [0,1,0,0,1,0|0,0,1]=3 990 B13R2.10 OC1CCN(C1)c2cccnn2 27a_100011215560_100016991348 [0,1,0,0,1,0|2,0,0]=4 991 B13R2.10 OC1CCN(C1)c2ccncn2 27a_100011215560_100000703185 [0,1,0,0,1,0|2,0,0]=4 992 B13R2.10 OC1CCN(C1)c2cnccn2 27a_100011215560_100000211759 [0,1,0,0,1,0|2,0,0]=4 993 B13R2.10 OC1CCN(C1)c2ncccn2 27a_100011215560_100000211032 [0,1,0,0,1,0|0,0,0]=2 994 B13R2.10 Oc1cnc(s1)N2CCOCC2 271570a_203496583355_100012356742 [0,1,0,0,1,0|2,0,0]=4 995 B13R2.10 Oc1cnn(c1)C2CCNCC2 271570a_203496583355_100000754150 [0,1,0,0,1,0|2,0,0]=4 996 B13R2.10 Oc1csc(n1)N2CCNCC2 271570a_203496583355_100012355768 [0,1,0,0,1,0|1,0,0]=3 997 B13R2.10 Oc1csc(n1)N2CCOCC2 271570a_203496583355_100000697515 [0,1,0,0,1,0|2,0,0]=4 998 B13R2.10 Oc1n[nH]c(n1)N2CCNCC2 271570a_203496583355_100159270639 [0,1,0,0,1,0|1,0,1]=4 999 B13R2.10 Oc1nc(no1)N2CCOCC2 270196a_100011217613_100015183105 [0,1,0,0,1,0|2,0,0]=4 1000 B13R2.10 [13CH3]N1CCC(C1)c2ccccn2 2230a_100102730755_200025704644 [0,1,0,0,1,0|2,0,0]=4 1001 B13R2.10 [13CH3]N1CCC(C1)c2ccccn2 269982a_100102730755_200025704644 [0,1,0,0,1,0|2,0,0]=4 1002 B13R2.12 Brc1ccc(nc1)N2CCCC2 27a_100000188435_100000686858 [0,1,0,0,1,0|1,0,0]=3 1003 B13R2.12 Brc1ccc(nc1)N2CCSC2 27a_100011215254_100000686858 [0,1,0,0,1,0|2,0,0]=4 1004 B13R2.12 Brc1cnc(cn1)N2CCCC2 27a_100000188435_100010187541 [0,1,0,0,1,0|2,0,0]=4 1005 B13R2.12 Brc1cnc(nc1)C2=CCCC2 271570a_100000089523_100000690281 [0,1,0,0,1,0|1,0,1]=4 1006 B13R2.12 Brc1cnc(nc1)N2CC=CC2 27a_100015195280_100000690281 [0,1,0,0,1,0|0,0,2]=4 1007 B13R2.12 Brc1cnc(nc1)N2CCCC2 27a_100000188435_100000690281 [0,1,0,0,1,0|0,0,0]=2 1008 B13R2.12 Brc1cnc(nc1)N2CCSC2 27a_100011215254_100000690281 [0,1,0,0,1,0|1,0,0]=3 1009 B13R2.12 CN1CCC(CC1)c2cc[nH]n2 2230a_100000058101_200000210301 [0,1,0,0,1,0|2,0,0]=4 1010 B13R2.12 CN1CCC(CC1)c2cc[nH]n2 269982a_100000058101_200000210301 [0,1,0,0,1,0|2,0,0]=4 1011 B13R2.12 CN1CCC(CC1)c2nccs2 2230a_100000750106_200000210301 [0,1,0,0,1,0|2,0,0]=4 1012 B13R2.12 CN1CCC(CC1)c2nccs2 269982a_100000750106_200000210301 [0,1,0,0,1,0|2,0,0]=4 1013 B13R2.12 CN1CCC(CC1)n2cccn2 2230a_100000741002_200000210301 [0,1,0,0,1,0|2,0,0]=4 1014 B13R2.12 CN1CCC(CC1)n2cccn2 269982a_100000741002_200000210301 [0,1,0,0,1,0|2,0,0]=4 1015 B13R2.12 CN1CCC(CC1)n2nccn2 2230a_100000100976_200000210301 [0,1,0,0,1,0|2,0,0]=4 1016 B13R2.12 CN1CCC(CC1)n2nccn2 269982a_100000100976_200000210301 [0,1,0,0,1,0|2,0,0]=4 1017 B13R2.12 CN1CCN(CC1)c2nccs2 2230a_100020646779_200000210301 [0,1,0,0,1,0|1,0,0]=3 1018 B13R2.12 CN1CCN(CC1)c2nccs2 269982a_100020646779_200000210301 [0,1,0,0,1,0|1,0,0]=3 1019 B13R2.12 CN1CCN(CC1)c2ncns2 27a_100000188432_100000693119 [0,1,0,0,1,0|2,0,0]=4 1020 B13R2.12 CN1CCN(CC1)c2nncs2 27a_100000188432_100000739804 [0,1,0,0,1,0|2,0,0]=4 1021 B13R2.12 Cc1ccc(nn1)N2CCCC2 27a_100000188435_100000744512 [0,1,0,0,1,0|2,0,0]=4 1022 B13R2.12 Cc1cnc(cn1)N2CCCC2 27a_100000188435_100000074397 [0,1,0,0,1,0|2,0,0]=4 1023 B13R2.12 Cc1cnc(nc1)C2=CCCC2 271570a_100000089523_100011825175 [0,1,0,0,1,0|1,0,1]=4 1024 B13R2.12 Cc1cnc(nc1)N2CC=CC2 27a_100015195280_100000061069 [0,1,0,0,1,0|0,0,2]=4 1025 B13R2.12 Cc1cnc(nc1)N2CCCC2 27a_100000188435_100000061069 [0,1,0,0,1,0|0,0,0]=2 1026 B13R2.12 Cc1cnc(nc1)N2CCSC2 27a_100011215254_100000061069 [0,1,0,0,1,0|1,0,0]=3 1027 B13R2.12 Clc1cnc(nc1)C2=CCCC2 271570a_100000089523_100011356929 [0,1,0,0,1,0|1,0,1]=4 1028 B13R2.12 Clc1cnc(nc1)N2CC=CC2 27a_100015195280_100011356929 [0,1,0,0,1,0|0,0,2]=4 1029 B13R2.12 Clc1cnc(nc1)N2CCCC2 27a_100000188435_100011356929 [0,1,0,0,1,0|0,0,0]=2 1030 B13R2.12 Clc1cnc(nc1)N2CCSC2 27a_100011215254_100011356929 [0,1,0,0,1,0|1,0,0]=3 1031 B13R2.12 Fc1cnc(cn1)N2CCCC2 27a_100000188435_100009856528 [0,1,0,0,1,0|2,0,0]=4 1032 B13R2.12 Fc1cnc(nc1)C2=CCCC2 271570a_100000089523_100000685220 [0,1,0,0,1,0|1,0,1]=4 1033 B13R2.12 Fc1cnc(nc1)N2CC=CC2 27a_100015195280_100000685220 [0,1,0,0,1,0|0,0,2]=4 1034 B13R2.12 Fc1cnc(nc1)N2CCCC2 27a_100000188435_100000685220 [0,1,0,0,1,0|0,0,0]=2 1035 B13R2.12 Fc1cnc(nc1)N2CCSC2 27a_100011215254_100000685220 [0,1,0,0,1,0|1,0,0]=3 1036 B13R2.12 Nc1cnc(nc1)C2=CCCC2 271570a_100000089523_100000068403 [0,1,0,0,1,0|1,0,1]=4 1037 B13R2.12 Oc1ccc(cc1)N2CCCC2 271570a_203496583355_100011821362 [0,1,0,0,1,0|2,0,0]=4 1038 B13R2.12 Oc1ccc(nc1)N2CCCC2 271570a_203496583355_100011465328 [0,1,0,0,1,0|1,0,0]=3 1039 B13R2.12 Oc1ccc(nn1)N2CCCC2 271570a_203496583355_100000215317 [0,1,0,0,1,0|2,0,0]=4 1040 B13R2.12 Oc1cnc(cn1)N2CCCC2 271570a_203496583355_100012356707 [0,1,0,0,1,0|2,0,0]=4 1041 B13R2.12 Oc1cnc(nc1)C2=CCCC2 271570a_100000089523_100000730009 [0,1,0,0,1,0|1,0,1]=4 1042 B13R2.12 Oc1cnc(nc1)N2CCCC2 271570a_203496583355_100011397822 [0,1,0,0,1,0|0,0,0]=2 1043 B13R2.12 [13CH3]N1CCC(CC1)c2cc[nH]n2 2230a_100000058101_200025704644 [0,1,0,0,1,0|2,0,0]=4 1044 B13R2.12 [13CH3]N1CCC(CC1)c2cc[nH]n2 269982a_100000058101_200025704644 [0,1,0,0,1,0|2,0,0]=4 1045 B13R2.12 [13CH3]N1CCC(CC1)c2nccs2 2230a_100000750106_200025704644 [0,1,0,0,1,0|2,0,0]=4 1046 B13R2.12 [13CH3]N1CCC(CC1)c2nccs2 269982a_100000750106_200025704644 [0,1,0,0,1,0|2,0,0]=4 1047 B13R2.12 [13CH3]N1CCC(CC1)n2cccn2 2230a_100000741002_200025704644 [0,1,0,0,1,0|2,0,0]=4 1048 B13R2.12 [13CH3]N1CCC(CC1)n2cccn2 269982a_100000741002_200025704644 [0,1,0,0,1,0|2,0,0]=4 1049 B13R2.12 [13CH3]N1CCC(CC1)n2nccn2 2230a_100000100976_200025704644 [0,1,0,0,1,0|2,0,0]=4 1050 B13R2.12 [13CH3]N1CCC(CC1)n2nccn2 269982a_100000100976_200025704644 [0,1,0,0,1,0|2,0,0]=4 1051 B13R2.12 [13CH3]N1CCN(CC1)c2nccs2 2230a_100020646779_200025704644 [0,1,0,0,1,0|1,0,0]=3 1052 B13R2.12 [13CH3]N1CCN(CC1)c2nccs2 269982a_100020646779_200025704644 [0,1,0,0,1,0|1,0,0]=3 1053 B13R2.13 Cc1cc(ncn1)N2CCCC2 27a_100000188435_100000744208 [0,1,0,0,1,0|2,0,0]=4 1054 B13R2.13 Cc1ccnc(n1)C2=CCCC2 271570a_100000089523_100011243806 [0,1,0,0,1,0|1,0,1]=4 1055 B13R2.13 Cc1ccnc(n1)N2CC=CC2 27a_100015195280_100000750684 [0,1,0,0,1,0|0,0,2]=4 1056 B13R2.13 Cc1ccnc(n1)N2CCCC2 27a_100000188435_100000750684 [0,1,0,0,1,0|0,0,0]=2 1057 B13R2.13 Cc1ccnc(n1)N2CCSC2 27a_100011215254_100000750684 [0,1,0,0,1,0|1,0,0]=3 1058 B13R2.13 Cc1cncc(n1)N2CCCC2 27a_100000188435_100000754123 [0,1,0,0,1,0|2,0,0]=4 1059 B13R2.13 Cc1cnnc(c1)N2CCCC2 27a_100000188435_100000070100 [0,1,0,0,1,0|2,0,0]=4 1060 B13R2.13 Cc1nccc(n1)N2CCCC2 27a_100000188435_100000749937 [0,1,0,0,1,0|2,0,0]=4 1061 B13R2.13 Clc1cncc(n1)N2CCCC2 27a_100000188435_100010892449 [0,1,0,0,1,0|2,0,0]=4 1062 B13R2.13 Fc1cc(ncn1)N2CCCC2 27a_100000188435_200009880791 [0,1,0,0,1,0|2,0,0]=4 1063 B13R2.13 Fc1cccc(n1)N2CCCC2 27a_100000188435_100009815982 [0,1,0,0,1,0|1,0,0]=3 1064 B13R2.13 Fc1cccc(n1)N2CCSC2 27a_100011215254_100009815982 [0,1,0,0,1,0|2,0,0]=4 1065 B13R2.13 Fc1ccnc(c1)N2CCCC2 27a_100000188435_100000764206 [0,1,0,0,1,0|1,0,0]=3 1066 B13R2.13 Fc1ccnc(c1)N2CCSC2 27a_100011215254_100000764206 [0,1,0,0,1,0|2,0,0]=4 1067 B13R2.13 Fc1cncc(n1)N2CCCC2 27a_100000188435_200009863489 [0,1,0,0,1,0|2,0,0]=4 1068 B13R2.13 Nc1cc(ncn1)N2CCCC2 27a_100000188435_100000701291 [0,1,0,0,1,0|2,0,0]=4 1069 B13R2.13 Nc1ccnc(n1)C2=CCCC2 271570a_100000089523_100000757536 [0,1,0,0,1,0|1,0,1]=4 1070 B13R2.13 Nc1ccnc(n1)N2CC=CC2 27a_100015195280_100000757536 [0,1,0,0,1,0|0,0,2]=4 1071 B13R2.13 Nc1ccnc(n1)N2CCCC2 27a_100000188435_100000757536 [0,1,0,0,1,0|0,0,0]=2 1072 B13R2.13 Nc1ccnc(n1)N2CCSC2 27a_100011215254_100000757536 [0,1,0,0,1,0|1,0,0]=3 1073 B13R2.13 Nc1nccc(n1)N2CCCC2 27a_100000188435_100000055538 [0,1,0,0,1,0|2,0,0]=4 1074 B13R2.13 Nc1ncnc(n1)N2CCCC2 27a_100000188435_100000123831 [0,1,0,0,1,0|1,0,0]=3 1075 B13R2.13 Nc1ncnc(n1)N2CCSC2 27a_100011215254_100000123831 [0,1,0,0,1,0|2,0,0]=4 1076 B13R2.13 O=c1nc(cc[nH]1)N2CCCC2 27a_100000188435_200000134032 [0,1,0,0,1,0|2,0,0]=4 1077 B13R2.13 Oc1cc(ncn1)N2CCCC2 271570a_203496583355_100000242485 [0,1,0,0,1,0|2,0,0]=4 1078 B13R2.13 Oc1cc(ncn1)N2CCCC2 27a_100000188435_100000765262 [0,1,0,0,1,0|2,0,0]=4 1079 B13R2.13 Oc1cccc(c1)N2CCCC2 271570a_203496583355_100020633440 [0,1,0,0,1,0|2,0,0]=4 1080 B13R2.13 Oc1cccc(n1)N2CCCC2 271570a_203496583355_100011934661 [0,1,0,0,1,0|1,0,0]=3 1081 B13R2.13 Oc1ccnc(c1)N2CCCC2 271570a_203496583355_100000728026 [0,1,0,0,1,0|1,0,0]=3 1082 B13R2.13 Oc1ccnc(n1)C2=CCCC2 271570a_100000089523_100011649813 [0,1,0,0,1,0|1,0,1]=4 1083 B13R2.13 Oc1ccnc(n1)N2CC=CC2 27a_100015195280_100011649813 [0,1,0,0,1,0|0,0,2]=4 1084 B13R2.13 Oc1ccnc(n1)N2CCCC2 271570a_203496583355_100011439827 [0,1,0,0,1,0|0,0,0]=2 1085 B13R2.13 Oc1ccnc(n1)N2CCCC2 27a_100000188435_100011649813 [0,1,0,0,1,0|0,0,0]=2 1086 B13R2.13 Oc1ccnc(n1)N2CCSC2 27a_100011215254_100011649813 [0,1,0,0,1,0|1,0,0]=3 1087 B13R2.13 Oc1cncc(n1)N2CCCC2 271570a_203496583355_100000243943 [0,1,0,0,1,0|2,0,0]=4 1088 B13R2.13 Oc1nccc(n1)N2CCCC2 271570a_203496583355_100000753041 [0,1,0,0,1,0|2,0,0]=4 1089 B13R2.13 [O-][n+]1ccnc(c1)N2CCCC2 27a_100000188435_100009880115 [0,1,0,0,1,0|2,0,0]=4 1090 B13R2.15 CC1SCCN1c2ncccn2 27a_200011216479_100000211032 [0,1,0,0,1,0|1,0,0]=3 1091 B13R2.15 C[C@@H]1CCCN1c2cccnn2 27a_100015189458_100016991348 [0,1,0,0,1,0|2,0,0]=4 1092 B13R2.15 C[C@@H]1CCCN1c2ccncn2 27a_100015189458_100000703185 [0,1,0,0,1,0|2,0,0]=4 1093 B13R2.15 C[C@@H]1CCCN1c2cnccn2 27a_100015189458_100000211759 [0,1,0,0,1,0|2,0,0]=4 1094 B13R2.15 C[C@@H]1CCCN1c2ncccn2 27a_100015189458_100000211032 [0,1,0,0,1,0|0,0,0]=2 1095 B13R2.15 C[C@H]1CCCN1c2cccnn2 27a_100020605311_100016991348 [0,1,0,0,1,0|2,0,0]=4 1096 B13R2.15 C[C@H]1CCCN1c2ccncn2 27a_100020605311_100000703185 [0,1,0,0,1,0|2,0,0]=4 1097 B13R2.15 C[C@H]1CCCN1c2cnccn2 27a_100020605311_100000211759 [0,1,0,0,1,0|2,0,0]=4 1098 B13R2.15 C[C@H]1CCCN1c2ncccn2 27a_100020605311_100000211032 [0,1,0,0,1,0|0,0,0]=2 1099 B13R2.18 Brc1cccnc1N2CCCC2 27a_100000188435_100000696092 [0,1,0,0,1,0|1,0,0]=3 1100 B13R2.18 Brc1cccnc1N2CCSC2 27a_100011215254_100000696092 [0,1,0,0,1,0|2,0,0]=4 1101 B13R2.18 Cc1ccnnc1N2CCCC2 27a_100000188435_100000089043 [0,1,0,0,1,0|2,0,0]=4 1102 B13R2.18 Cc1cncnc1N2CCCC2 27a_100000188435_100011998708 [0,1,0,0,1,0|2,0,0]=4 1103 B13R2.18 Cc1nccnc1N2CCCC2 27a_100000188435_100011999405 [0,1,0,0,1,0|2,0,0]=4 1104 B13R2.18 Fc1cncnc1N2CCCC2 27a_100000188435_100000069762 [0,1,0,0,1,0|2,0,0]=4 1105 B13R2.18 Fc1nccnc1N2CCCC2 27a_100000188435_200010125657 [0,1,0,0,1,0|2,0,0]=4 1106 B13R2.18 Nc1cncnc1N2CCCC2 27a_100000188435_100000709731 [0,1,0,0,1,0|2,0,0]=4 1107 B13R2.18 Oc1ccccc1N2CCCC2 271570a_203496583355_100011821364 [0,1,0,0,1,0|2,0,0]=4 1108 B13R2.18 Oc1cccnc1N2CCCC2 271570a_203496583355_200103154644 [0,1,0,0,1,0|1,0,0]=3 1109 B13R2.18 Oc1nccnc1N2CCCC2 271570a_203496583355_200011529397 [0,1,0,0,1,0|2,0,0]=4 1110 B15R2.29 Brc1ccc(nc1)CN2CCOCC2 2230a_100015191051_100000702658 [0,1,0,0,0,1|2,0,0]=4 1111 B15R2.29 Brc1ccc(nc1)CN2CCOCC2 269982a_100015191051_100000702658 [0,1,0,0,0,1|2,0,0]=4 1112 B15R2.29 Brc1ccc(nc1)CN2CCOCC2 270004a_100015191051_100000754260 [0,1,0,0,0,1|2,0,0]=4 1113 B15R2.29 Brc1ccc(nc1)CN2CCOCC2 34a_100015191051_100000702658 [0,1,0,0,0,1|2,0,0]=4 1114 B15R2.29 Brc1ccc(nc1)CN2CCSCC2 2230a_100000737611_100000702658 [0,1,0,0,0,1|2,0,0]=4 1115 B15R2.29 Brc1ccc(nc1)CN2CCSCC2 269982a_100000737611_100000702658 [0,1,0,0,0,1|2,0,0]=4 1116 B15R2.29 Brc1ccc(nc1)CN2CCSCC2 270004a_100000737611_100000754260 [0,1,0,0,0,1|2,0,0]=4 1117 B15R2.29 Brc1cnc(nc1)CN2CC=CCC2 269982a_100000698166_100010064664 [0,1,0,0,0,1|1,0,1]=4 1118 B15R2.29 Brc1cnc(nc1)CN2CC=CCC2 34a_100000698166_100010064664 [0,1,0,0,0,1|1,0,1]=4 1119 B15R2.29 Brc1cnc(nc1)CN2CCCOC2 269982a_100000131196_100010064664 [0,1,0,0,0,1|2,0,0]=4 1120 B15R2.29 Brc1cnc(nc1)CN2CCCOC2 34a_100000131196_100010064664 [0,1,0,0,0,1|2,0,0]=4 1121 B15R2.29 Brc1cnc(nc1)CN2CCOCC2 269982a_100015191051_100010064664 [0,1,0,0,0,1|1,0,0]=3 1122 B15R2.29 Brc1cnc(nc1)CN2CCOCC2 34a_100015191051_100010064664 [0,1,0,0,0,1|1,0,0]=3 1123 B15R2.29 Brc1cnc(nc1)CN2CCSCC2 269982a_100000737611_100010064664 [0,1,0,0,0,1|1,0,0]=3 1124 B15R2.29 Brc1cnc(nc1)NC2CCCCC2 27a_100000182618_100000690281 [0,1,0,0,0,1|2,0,0]=4 1125 B15R2.29 Brc1cnc(nc1)NC2CCOCC2 27a_100000741149_100000690281 [0,1,0,0,0,1|2,0,0]=4 1126 B15R2.29 Brc1cnc(nc1)NC2CCSCC2 27a_100000748639_100000690281 [0,1,0,0,0,1|2,0,0]=4 1127 B15R2.29 Brc1cnc(nc1)SC2CCCCC2 62a_100000210327_100000690281 [0,1,0,0,0,1|2,0,0]=4 1128 B15R2.29 Brc1cnc(nc1)SC2CCCCC2 62a_100000690281_100000210327 [0,1,0,0,0,1|2,0,0]=4 1129 B15R2.29 Brc1cnc(nc1)SC2CCOCC2 62a_100000690281_100011324220 [0,1,0,0,0,1|2,0,0]=4 1130 B15R2.29 Brc1cnc(nc1)SC2CCSCC2 62a_100000690281_100000069128 [0,1,0,0,0,1|2,0,0]=4 1131 B15R2.29 C=C1CCN(CC1)Cc2ccccn2 2230a_100000752442_100000721315 [0,1,0,0,0,1|2,0,0]=4 1132 B15R2.29 C=C1CCN(CC1)Cc2ccccn2 269982a_100000752442_100000721315 [0,1,0,0,0,1|2,0,0]=4 1133 B15R2.29 C=C1CCN(CC1)Cc2ccccn2 270004a_100000752442_100000209966 [0,1,0,0,0,1|2,0,0]=4 1134 B15R2.29 C=C1CCN(CC1)Cc2ccccn2 34a_100000752442_100000721315 [0,1,0,0,0,1|2,0,0]=4 1135 B15R2.29 C=C1CCN(CC1)Cc2ncccn2 2230a_100000752442_100000703007 [0,1,0,0,0,1|1,0,0]=3 1136 B15R2.29 C=C1CCN(CC1)Cc2ncccn2 269982a_100000752442_100000703007 [0,1,0,0,0,1|1,0,0]=3 1137 B15R2.29 C=C1CCN(CC1)Cc2ncccn2 270004a_100000752442_100011532527 [0,1,0,0,0,1|1,0,0]=3 1138 B15R2.29 C=C1CCN(CC1)Cc2ncccn2 34a_100000752442_100000703007 [0,1,0,0,0,1|1,0,0]=3 1139 B15R2.29 CC1=CCN(CC1)Cc2ncccn2 2230a_100000693516_100000703007 [0,1,0,0,0,1|1,0,1]=4 1140 B15R2.29 CC1=CCN(CC1)Cc2ncccn2 269982a_100000693516_100000703007 [0,1,0,0,0,1|1,0,1]=4 1141 B15R2.29 CC1=CCN(CC1)Cc2ncccn2 270004a_100000693516_100011532527 [0,1,0,0,0,1|1,0,1]=4 1142 B15R2.29 CC1=CCN(CC1)Cc2ncccn2 34a_100000693516_100000703007 [0,1,0,0,0,1|1,0,1]=4 1143 B15R2.29 CC1CCC(CC1)Sc2ncccn2 62a_100000211032_200011216234 [0,1,0,0,0,1|2,0,0]=4 1144 B15R2.29 CC1CCN(CC1)Cc2ccccn2 2230a_100000188429_100000721315 [0,1,0,0,0,1|2,0,0]=4 1145 B15R2.29 CC1CCN(CC1)Cc2ccccn2 269982a_100000188429_100000721315 [0,1,0,0,0,1|2,0,0]=4 1146 B15R2.29 CC1CCN(CC1)Cc2ccccn2 270004a_100000188429_100000209966 [0,1,0,0,0,1|2,0,0]=4 1147 B15R2.29 CC1CCN(CC1)Cc2ccccn2 34a_100000188429_100000721315 [0,1,0,0,0,1|2,0,0]=4 1148 B15R2.29 CC1CCN(CC1)Cc2ncccn2 2230a_100000188429_100000703007 [0,1,0,0,0,1|1,0,0]=3 1149 B15R2.29 CC1CCN(CC1)Cc2ncccn2 269982a_100000188429_100000703007 [0,1,0,0,0,1|1,0,0]=3 1150 B15R2.29 CC1CCN(CC1)Cc2ncccn2 270004a_100000188429_100011532527 [0,1,0,0,0,1|1,0,0]=3 1151 B15R2.29 CC1CCN(CC1)Cc2ncccn2 34a_100000188429_100000703007 [0,1,0,0,0,1|1,0,0]=3 1152 B15R2.29 CN1CCC(CC1)Nc2ncccn2 27a_100000198570_100000211032 [0,1,0,0,0,1|1,0,0]=3 1153 B15R2.29 CN1CCC(CC1)Oc2ccccn2 2230a_100000704480_200000210301 [0,1,0,0,0,1|2,0,0]=4 1154 B15R2.29 CN1CCC(CC1)Oc2ccccn2 269982a_100000704480_200000210301 [0,1,0,0,0,1|2,0,0]=4 1155 B15R2.29 CN1CCC(CC1)Oc2ncccn2 2230a_100011220031_200000210301 [0,1,0,0,0,1|1,0,0]=3 1156 B15R2.29 CN1CCC(CC1)Oc2ncccn2 269982a_100011220031_200000210301 [0,1,0,0,0,1|1,0,0]=3 1157 B15R2.29 CN1CCC(CC1)Sc2ccccn2 2230a_100000762822_200000210301 [0,1,0,0,0,1|2,0,0]=4 1158 B15R2.29 CN1CCC(CC1)Sc2ccccn2 269982a_100000762822_200000210301 [0,1,0,0,0,1|2,0,0]=4 1159 B15R2.29 CN1CCC(CC1)Sc2ccccn2 62a_100011216584_100011215917 [0,1,0,0,0,1|2,0,0]=4 1160 B15R2.29 CN1CCC(CC1)Sc2ncccn2 62a_100000211032_100011215917 [0,1,0,0,0,1|1,0,0]=3 1161 B15R2.29 CN1CCN(CC1)Cc2ccccc2 2230a_100000188432_100015291786 [0,1,0,0,0,1|2,0,0]=4 1162 B15R2.29 CN1CCN(CC1)Cc2ccccc2 269982a_100000188432_100000211182 [0,1,0,0,0,1|2,0,0]=4 1163 B15R2.29 CN1CCN(CC1)Cc2ccccc2 270004a_100000188432_100015611070 [0,1,0,0,0,1|2,0,0]=4 1164 B15R2.29 CN1CCN(CC1)Cc2ccccn2 2230a_100000188432_100000721315 [0,1,0,0,0,1|1,0,0]=3 1165 B15R2.29 CN1CCN(CC1)Cc2ccccn2 2230a_100000229886_200000210301 [0,1,0,0,0,1|1,0,0]=3 1166 B15R2.29 CN1CCN(CC1)Cc2ccccn2 269982a_100000188432_100000721315 [0,1,0,0,0,1|1,0,0]=3 1167 B15R2.29 CN1CCN(CC1)Cc2ccccn2 269982a_100000229886_200000210301 [0,1,0,0,0,1|1,0,0]=3 1168 B15R2.29 CN1CCN(CC1)Cc2ccccn2 270004a_100000188432_100000209966 [0,1,0,0,0,1|1,0,0]=3 1169 B15R2.29 CN1CCN(CC1)Cc2cccnn2 2230a_100000188432_100016990269 [0,1,0,0,0,1|2,0,0]=4 1170 B15R2.29 CN1CCN(CC1)Cc2cnccn2 2230a_100000188432_100016995436 [0,1,0,0,0,1|2,0,0]=4 1171 B15R2.29 CN1CCN(CC1)Cc2cnccn2 269982a_100000188432_100016995436 [0,1,0,0,0,1|2,0,0]=4 1172 B15R2.29 CN1CCN(CC1)Cc2cnccn2 270004a_100000188432_100000749867 [0,1,0,0,0,1|2,0,0]=4 1173 B15R2.29 CN1CCN(CC1)Cc2ncccn2 2230a_100000188432_100000703007 [0,1,0,0,0,1|0,0,0]=2 1174 B15R2.29 CN1CCN(CC1)Cc2ncccn2 269982a_100000188432_100000703007 [0,1,0,0,0,1|0,0,0]=2 1175 B15R2.29 CN1CCN(CC1)Cc2ncccn2 270004a_100000188432_100011532527 [0,1,0,0,0,1|0,0,0]=2 1176 B15R2.29 C[C@H]1CC[C@@H](CC1)Nc2ncccn2 27a_100020625639_100000211032 [0,1,0,0,0,1|2,0,0]=4 1177 B15R2.29 Cc1ccc(nc1)CN2CCOCC2 2230a_100015191051_100000691093 [0,1,0,0,0,1|2,0,0]=4 1178 B15R2.29 Cc1ccc(nc1)CN2CCOCC2 269982a_100015191051_100000691093 [0,1,0,0,0,1|2,0,0]=4 1179 B15R2.29 Cc1ccc(nc1)CN2CCOCC2 270004a_100015191051_100000050478 [0,1,0,0,0,1|2,0,0]=4 1180 B15R2.29 Cc1ccc(nc1)CN2CCOCC2 34a_100015191051_100000691093 [0,1,0,0,0,1|2,0,0]=4 1181 B15R2.29 Cc1ccc(nc1)CN2CCSCC2 2230a_100000737611_100000691093 [0,1,0,0,0,1|2,0,0]=4 1182 B15R2.29 Cc1ccc(nc1)CN2CCSCC2 269982a_100000737611_100000691093 [0,1,0,0,0,1|2,0,0]=4 1183 B15R2.29 Cc1ccc(nc1)CN2CCSCC2 270004a_100000737611_100000050478 [0,1,0,0,0,1|2,0,0]=4 1184 B15R2.29 Cc1cnc(nc1)CN2CC=CCC2 2230a_100000698166_100000685645 [0,1,0,0,0,1|1,0,1]=4 1185 B15R2.29 Cc1cnc(nc1)CN2CC=CCC2 269982a_100000698166_100000685645 [0,1,0,0,0,1|1,0,1]=4 1186 B15R2.29 Cc1cnc(nc1)CN2CC=CCC2 34a_100000698166_100000685645 [0,1,0,0,0,1|1,0,1]=4 1187 B15R2.29 Cc1cnc(nc1)CN2CCCOC2 2230a_100000131196_100000685645 [0,1,0,0,0,1|2,0,0]=4 1188 B15R2.29 Cc1cnc(nc1)CN2CCCOC2 269982a_100000131196_100000685645 [0,1,0,0,0,1|2,0,0]=4 1189 B15R2.29 Cc1cnc(nc1)CN2CCCOC2 34a_100000131196_100000685645 [0,1,0,0,0,1|2,0,0]=4 1190 B15R2.29 Cc1cnc(nc1)CN2CCOCC2 2230a_100015191051_100000685645 [0,1,0,0,0,1|1,0,0]=3 1191 B15R2.29 Cc1cnc(nc1)CN2CCOCC2 269982a_100015191051_100000685645 [0,1,0,0,0,1|1,0,0]=3 1192 B15R2.29 Cc1cnc(nc1)CN2CCOCC2 34a_100015191051_100000685645 [0,1,0,0,0,1|1,0,0]=3 1193 B15R2.29 Cc1cnc(nc1)CN2CCSCC2 2230a_100000737611_100000685645 [0,1,0,0,0,1|1,0,0]=3 1194 B15R2.29 Cc1cnc(nc1)CN2CCSCC2 269982a_100000737611_100000685645 [0,1,0,0,0,1|1,0,0]=3 1195 B15R2.29 Cc1cnc(nc1)NC2CCCCC2 27a_100000182618_100000061069 [0,1,0,0,0,1|2,0,0]=4 1196 B15R2.29 Cc1cnc(nc1)NC2CCOCC2 27a_100000741149_100000061069 [0,1,0,0,0,1|2,0,0]=4 1197 B15R2.29 Cc1cnc(nc1)NC2CCSCC2 27a_100000748639_100000061069 [0,1,0,0,0,1|2,0,0]=4 1198 B15R2.29 Cc1cnc(nc1)SC2CCCCC2 62a_100000061069_100000210327 [0,1,0,0,0,1|2,0,0]=4 1199 B15R2.29 Cc1cnc(nc1)SC2CCCCC2 62a_100000210327_100000061069 [0,1,0,0,0,1|2,0,0]=4 1200 B15R2.29 Cc1cnc(nc1)SC2CCOCC2 62a_100000061069_100011324220 [0,1,0,0,0,1|2,0,0]=4 1201 B15R2.29 Cc1cnc(nc1)SC2CCSCC2 62a_100000061069_100000069128 [0,1,0,0,0,1|2,0,0]=4 1202 B15R2.29 Clc1ccc(nc1)CN2CCOCC2 2230a_100015191051_100012066911 [0,1,0,0,0,1|2,0,0]=4 1203 B15R2.29 Clc1ccc(nc1)CN2CCOCC2 269982a_100015191051_100000697101 [0,1,0,0,0,1|2,0,0]=4 1204 B15R2.29 Clc1ccc(nc1)CN2CCOCC2 270004a_100015191051_100011361569 [0,1,0,0,0,1|2,0,0]=4 1205 B15R2.29 Clc1ccc(nc1)CN2CCOCC2 34a_100015191051_100012066911 [0,1,0,0,0,1|2,0,0]=4 1206 B15R2.29 Clc1ccc(nc1)CN2CCSCC2 2230a_100000737611_100012066911 [0,1,0,0,0,1|2,0,0]=4 1207 B15R2.29 Clc1ccc(nc1)CN2CCSCC2 269982a_100000737611_100000697101 [0,1,0,0,0,1|2,0,0]=4 1208 B15R2.29 Clc1ccc(nc1)CN2CCSCC2 270004a_100000737611_100011361569 [0,1,0,0,0,1|2,0,0]=4 1209 B15R2.29 Clc1cnc(nc1)NC2CCCCC2 27a_100000182618_100011356929 [0,1,0,0,0,1|2,0,0]=4 1210 B15R2.29 Clc1cnc(nc1)NC2CCOCC2 27a_100000741149_100011356929 [0,1,0,0,0,1|2,0,0]=4 1211 B15R2.29 Clc1cnc(nc1)NC2CCSCC2 27a_100000748639_100011356929 [0,1,0,0,0,1|2,0,0]=4 1212 B15R2.29 Clc1cnc(nc1)SC2CCCCC2 62a_100000210327_100011356929 [0,1,0,0,0,1|2,0,0]=4 1213 B15R2.29 Clc1cnc(nc1)SC2CCCCC2 62a_100011356929_100000210327 [0,1,0,0,0,1|2,0,0]=4 1214 B15R2.29 Clc1cnc(nc1)SC2CCOCC2 62a_100011356929_100011324220 [0,1,0,0,0,1|2,0,0]=4 1215 B15R2.29 Clc1cnc(nc1)SC2CCSCC2 62a_100011356929_100000069128 [0,1,0,0,0,1|2,0,0]=4 1216 B15R2.29 FC1CCN(CC1)Cc2ccccn2 2230a_100015193889_100000721315 [0,1,0,0,0,1|2,0,0]=4 1217 B15R2.29 FC1CCN(CC1)Cc2ccccn2 269982a_100015193889_100000721315 [0,1,0,0,0,1|2,0,0]=4 1218 B15R2.29 FC1CCN(CC1)Cc2ccccn2 270004a_100015193889_100000209966 [0,1,0,0,0,1|2,0,0]=4 1219 B15R2.29 FC1CCN(CC1)Cc2ccccn2 34a_100015193889_100000721315 [0,1,0,0,0,1|2,0,0]=4 1220 B15R2.29 FC1CCN(CC1)Cc2ncccn2 2230a_100015193889_100000703007 [0,1,0,0,0,1|1,0,0]=3 1221 B15R2.29 FC1CCN(CC1)Cc2ncccn2 269982a_100015193889_100000703007 [0,1,0,0,0,1|1,0,0]=3 1222 B15R2.29 FC1CCN(CC1)Cc2ncccn2 270004a_100015193889_100011532527 [0,1,0,0,0,1|1,0,0]=3 1223 B15R2.29 FC1CCN(CC1)Cc2ncccn2 34a_100015193889_100000703007 [0,1,0,0,0,1|1,0,0]=3 1224 B15R2.29 Fc1ccc(nc1)CN2CCOCC2 2230a_100015191051_100000703193 [0,1,0,0,0,1|2,0,0]=4 1225 B15R2.29 Fc1ccc(nc1)CN2CCOCC2 269982a_100015191051_100000703193 [0,1,0,0,0,1|2,0,0]=4 1226 B15R2.29 Fc1ccc(nc1)CN2CCOCC2 270004a_100015191051_100011934744 [0,1,0,0,0,1|2,0,0]=4 1227 B15R2.29 Fc1ccc(nc1)CN2CCOCC2 34a_100015191051_100000703193 [0,1,0,0,0,1|2,0,0]=4 1228 B15R2.29 Fc1ccc(nc1)CN2CCSCC2 2230a_100000737611_100000703193 [0,1,0,0,0,1|2,0,0]=4 1229 B15R2.29 Fc1ccc(nc1)CN2CCSCC2 269982a_100000737611_100000703193 [0,1,0,0,0,1|2,0,0]=4 1230 B15R2.29 Fc1ccc(nc1)CN2CCSCC2 270004a_100000737611_100011934744 [0,1,0,0,0,1|2,0,0]=4 1231 B15R2.29 Fc1cnc(nc1)NC2CCCCC2 27a_100000182618_100000685220 [0,1,0,0,0,1|2,0,0]=4 1232 B15R2.29 Fc1cnc(nc1)NC2CCOCC2 27a_100000741149_100000685220 [0,1,0,0,0,1|2,0,0]=4 1233 B15R2.29 Fc1cnc(nc1)NC2CCSCC2 27a_100000748639_100000685220 [0,1,0,0,0,1|2,0,0]=4 1234 B15R2.29 Fc1cnc(nc1)OC2CCCCC2 34a_100011934040_100000210327 [0,1,0,0,0,1|2,0,0]=4 1235 B15R2.29 Fc1cnc(nc1)OC2CCSCC2 34a_100011934040_100000069128 [0,1,0,0,0,1|2,0,0]=4 1236 B15R2.29 Fc1cnc(nc1)SC2CCCCC2 62a_100000210327_100000685220 [0,1,0,0,0,1|2,0,0]=4 1237 B15R2.29 Fc1cnc(nc1)SC2CCCCC2 62a_100000685220_100000210327 [0,1,0,0,0,1|2,0,0]=4 1238 B15R2.29 Fc1cnc(nc1)SC2CCOCC2 62a_100000685220_100011324220 [0,1,0,0,0,1|2,0,0]=4 1239 B15R2.29 Fc1cnc(nc1)SC2CCSCC2 62a_100000685220_100000069128 [0,1,0,0,0,1|2,0,0]=4 1240 B15R2.29 Nc1cnc(nc1)SC2CCCCC2 62a_100000068403_100000210327 [0,1,0,0,0,1|2,0,0]=4 1241 B15R2.29 Nc1cnc(nc1)SC2CCCCC2 62a_100000210327_100000068403 [0,1,0,0,0,1|2,0,0]=4 1242 B15R2.29 Nc1cnc(nc1)SC2CCOCC2 62a_100000068403_100011324220 [0,1,0,0,0,1|2,0,0]=4 1243 B15R2.29 Nc1cnc(nc1)SC2CCSCC2 62a_100000068403_100000069128 [0,1,0,0,0,1|2,0,0]=4 1244 B15R2.29 O=S1CCN(CC1)Cc2ccccn2 2230a_100000752083_100000721315 [0,1,0,0,0,1|2,0,0]=4 1245 B15R2.29 O=S1CCN(CC1)Cc2ccccn2 269982a_100000752083_100000721315 [0,1,0,0,0,1|2,0,0]=4 1246 B15R2.29 O=S1CCN(CC1)Cc2ccccn2 270004a_100000752083_100000209966 [0,1,0,0,0,1|2,0,0]=4 1247 B15R2.29 O=S1CCN(CC1)Cc2ncccn2 2230a_100000752083_100000703007 [0,1,0,0,0,1|1,0,0]=3 1248 B15R2.29 O=S1CCN(CC1)Cc2ncccn2 269982a_100000752083_100000703007 [0,1,0,0,0,1|1,0,0]=3 1249 B15R2.29 O=S1CCN(CC1)Cc2ncccn2 270004a_100000752083_100011532527 [0,1,0,0,0,1|1,0,0]=3 1250 B15R2.29 OC1CCN(CC1)Cc2ccccn2 2230a_100025773856_100000721315 [0,1,0,0,0,1|2,0,0]=4 1251 B15R2.29 OC1CCN(CC1)Cc2ccccn2 269982a_100025773856_100000721315 [0,1,0,0,0,1|2,0,0]=4 1252 B15R2.29 OC1CCN(CC1)Cc2ccccn2 270004a_100025773856_100000209966 [0,1,0,0,0,1|2,0,0]=4 1253 B15R2.29 OC1CCN(CC1)Cc2ncccn2 2230a_100025773856_100000703007 [0,1,0,0,0,1|1,0,0]=3 1254 B15R2.29 OC1CCN(CC1)Cc2ncccn2 269982a_100025773856_100000703007 [0,1,0,0,0,1|1,0,0]=3 1255 B15R2.29 OC1CCN(CC1)Cc2ncccn2 270004a_100025773856_100011532527 [0,1,0,0,0,1|1,0,0]=3 1256 B15R2.29 O[C@H]1CC[C@H](CC1)Nc2ncccn2 27a_100020628982_100000211032 [0,1,0,0,0,1|2,0,0]=4 1257 B15R2.29 Oc1ccc(cc1)CN2CCNCC2 271570a_203496583355_100000689693 [0,1,0,0,0,1|2,0,0]=4 1258 B15R2.29 Oc1ccc(nc1)CN2CCOCC2 271570a_203496583355_100011964287 [0,1,0,0,0,1|2,0,0]=4 1259 B15R2.29 Oc1cnc(nc1)NC2CCCCC2 271570a_203496583355_200011938754 [0,1,0,0,0,1|2,0,0]=4 1260 B15R2.29 Oc1cnc(nc1)OC2CCNCC2 271570a_203496583355_200011939016 [0,1,0,0,0,1|1,0,0]=3 1261 B15R2.29 Oc1cnc(nc1)SC2CCCCC2 271570a_203496583355_200011939556 [0,1,0,0,0,1|2,0,0]=4 1262 B15R2.29 Oc1cnc(nc1)SC2CCCCC2 62a_100000210327_100000092845 [0,1,0,0,0,1|2,0,0]=4 1263 B15R2.29 Oc1cnc(nc1)SC2CCCCC2 62a_100000730009_100000210327 [0,1,0,0,0,1|2,0,0]=4 1264 B15R2.29 Oc1cnc(nc1)SC2CCOCC2 62a_100000730009_100011324220 [0,1,0,0,0,1|2,0,0]=4 1265 B15R2.29 Oc1cnc(nc1)SC2CCSCC2 62a_100000730009_100000069128 [0,1,0,0,0,1|2,0,0]=4 1266 B15R2.29 [13CH3]N1CCC(CC1)Oc2ccccn2 2230a_100000704480_200025704644 [0,1,0,0,0,1|2,0,0]=4 1267 B15R2.29 [13CH3]N1CCC(CC1)Oc2ccccn2 269982a_100000704480_200025704644 [0,1,0,0,0,1|2,0,0]=4 1268 B15R2.29 [13CH3]N1CCC(CC1)Oc2ncccn2 2230a_100011220031_200025704644 [0,1,0,0,0,1|1,0,0]=3 1269 B15R2.29 [13CH3]N1CCC(CC1)Oc2ncccn2 269982a_100011220031_200025704644 [0,1,0,0,0,1|1,0,0]=3 1270 B15R2.29 [13CH3]N1CCC(CC1)Sc2ccccn2 2230a_100000762822_200025704644 [0,1,0,0,0,1|2,0,0]=4 1271 B15R2.29 [13CH3]N1CCC(CC1)Sc2ccccn2 269982a_100000762822_200025704644 [0,1,0,0,0,1|2,0,0]=4 1272 B15R2.29 [13CH3]N1CCN(CC1)Cc2ccccn2 2230a_100000229886_200025704644 [0,1,0,0,0,1|1,0,0]=3 1273 B15R2.29 [13CH3]N1CCN(CC1)Cc2ccccn2 269982a_100000229886_200025704644 [0,1,0,0,0,1|1,0,0]=3 1274 B15R2.31 Brc1cccc(n1)CN2CCOCC2 2230a_100015191051_100009889011 [0,1,0,0,0,1|2,0,0]=4 1275 B15R2.31 Brc1cccc(n1)CN2CCOCC2 269982a_100015191051_100009889011 [0,1,0,0,0,1|2,0,0]=4 1276 B15R2.31 Brc1cccc(n1)CN2CCOCC2 270004a_100015191051_100000688028 [0,1,0,0,0,1|2,0,0]=4 1277 B15R2.31 Brc1cccc(n1)CN2CCOCC2 34a_100015191051_100009889011 [0,1,0,0,0,1|2,0,0]=4 1278 B15R2.31 Brc1cccc(n1)CN2CCSCC2 2230a_100000737611_100009889011 [0,1,0,0,0,1|2,0,0]=4 1279 B15R2.31 Brc1cccc(n1)CN2CCSCC2 269982a_100000737611_100009889011 [0,1,0,0,0,1|2,0,0]=4 1280 B15R2.31 Brc1cccc(n1)CN2CCSCC2 270004a_100000737611_100000688028 [0,1,0,0,0,1|2,0,0]=4 1281 B15R2.31 Brc1ccnc(c1)CN2CCOCC2 2230a_100015191051_100010173614 [0,1,0,0,0,1|2,0,0]=4 1282 B15R2.31 Brc1ccnc(c1)CN2CCOCC2 269982a_100015191051_100010173614 [0,1,0,0,0,1|2,0,0]=4 1283 B15R2.31 Brc1ccnc(c1)CN2CCOCC2 270004a_100015191051_100009818557 [0,1,0,0,0,1|2,0,0]=4 1284 B15R2.31 Brc1ccnc(c1)CN2CCOCC2 34a_100015191051_100010173614 [0,1,0,0,0,1|2,0,0]=4 1285 B15R2.31 Brc1ccnc(c1)CN2CCSCC2 2230a_100000737611_100010173614 [0,1,0,0,0,1|2,0,0]=4 1286 B15R2.31 Brc1ccnc(c1)CN2CCSCC2 269982a_100000737611_100010173614 [0,1,0,0,0,1|2,0,0]=4 1287 B15R2.31 Brc1ccnc(c1)CN2CCSCC2 270004a_100000737611_100009818557 [0,1,0,0,0,1|2,0,0]=4 1288 B15R2.31 CC1=CCCN(C1)Cc2ncccn2 2230a_100000725631_100000703007 [0,1,0,0,0,1|1,0,1]=4 1289 B15R2.31 CC1=CCCN(C1)Cc2ncccn2 269982a_100000725631_100000703007 [0,1,0,0,0,1|1,0,1]=4 1290 B15R2.31 CC1=CCCN(C1)Cc2ncccn2 270004a_100000725631_100011532527 [0,1,0,0,0,1|1,0,1]=4 1291 B15R2.31 CC1=CCCN(C1)Cc2ncccn2 34a_100000725631_100000703007 [0,1,0,0,0,1|1,0,1]=4 1292 B15R2.31 CC1CCCC(C1)Nc2ncccn2 27a_100011194320_100000211032 [0,1,0,0,0,1|2,0,0]=4 1293 B15R2.31 CC1CN(CCO1)Cc2ccccn2 2230a_100000729577_100000721315 [0,1,0,0,0,1|2,0,0]=4 1294 B15R2.31 CC1CN(CCO1)Cc2ccccn2 269982a_100000729577_100000721315 [0,1,0,0,0,1|2,0,0]=4 1295 B15R2.31 CC1CN(CCO1)Cc2ccccn2 270004a_100000729577_100000209966 [0,1,0,0,0,1|2,0,0]=4 1296 B15R2.31 CC1CN(CCO1)Cc2ccccn2 34a_100000729577_100000721315 [0,1,0,0,0,1|2,0,0]=4 1297 B15R2.31 CC1CN(CCO1)Cc2ncccn2 2230a_100000729577_100000703007 [0,1,0,0,0,1|1,0,0]=3 1298 B15R2.31 CC1CN(CCO1)Cc2ncccn2 269982a_100000729577_100000703007 [0,1,0,0,0,1|1,0,0]=3 1299 B15R2.31 CC1CN(CCO1)Cc2ncccn2 270004a_100000729577_100011532527 [0,1,0,0,0,1|1,0,0]=3 1300 B15R2.31 CC1CN(CCO1)Cc2ncccn2 34a_100000729577_100000703007 [0,1,0,0,0,1|1,0,0]=3 1301 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccn2 2230a_100000717927_100000721315 [0,1,0,0,0,1|2,0,0]=4 1302 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccn2 269982a_100000717927_100000721315 [0,1,0,0,0,1|2,0,0]=4 1303 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccn2 270004a_100000717927_100000209966 [0,1,0,0,0,1|2,0,0]=4 1304 B15R2.31 C[C@H]1CCCN(C1)Cc2ccccn2 34a_100000717927_100000721315 [0,1,0,0,0,1|2,0,0]=4 1305 B15R2.31 C[C@H]1CCCN(C1)Cc2ncccn2 2230a_100000717927_100000703007 [0,1,0,0,0,1|1,0,0]=3 1306 B15R2.31 C[C@H]1CCCN(C1)Cc2ncccn2 269982a_100000717927_100000703007 [0,1,0,0,0,1|1,0,0]=3 1307 B15R2.31 C[C@H]1CCCN(C1)Cc2ncccn2 270004a_100000717927_100011532527 [0,1,0,0,0,1|1,0,0]=3 1308 B15R2.31 C[C@H]1CCCN(C1)Cc2ncccn2 34a_100000717927_100000703007 [0,1,0,0,0,1|1,0,0]=3 1309 B15R2.31 Cc1cccc(n1)CN2CCOCC2 2230a_100015191051_100000757606 [0,1,0,0,0,1|2,0,0]=4 1310 B15R2.31 Cc1cccc(n1)CN2CCOCC2 269982a_100015191051_100000757606 [0,1,0,0,0,1|2,0,0]=4 1311 B15R2.31 Cc1cccc(n1)CN2CCOCC2 270004a_100015191051_100011215050 [0,1,0,0,0,1|2,0,0]=4 1312 B15R2.31 Cc1cccc(n1)CN2CCOCC2 34a_100015191051_100000757606 [0,1,0,0,0,1|2,0,0]=4 1313 B15R2.31 Cc1cccc(n1)CN2CCSCC2 2230a_100000737611_100000757606 [0,1,0,0,0,1|2,0,0]=4 1314 B15R2.31 Cc1cccc(n1)CN2CCSCC2 269982a_100000737611_100000757606 [0,1,0,0,0,1|2,0,0]=4 1315 B15R2.31 Cc1cccc(n1)CN2CCSCC2 270004a_100000737611_100011215050 [0,1,0,0,0,1|2,0,0]=4 1316 B15R2.31 Cc1ccnc(c1)CN2CCOCC2 2230a_100015191051_100000718516 [0,1,0,0,0,1|2,0,0]=4 1317 B15R2.31 Cc1ccnc(c1)CN2CCOCC2 269982a_100015191051_100000718516 [0,1,0,0,0,1|2,0,0]=4 1318 B15R2.31 Cc1ccnc(c1)CN2CCOCC2 270004a_100015191051_100011361488 [0,1,0,0,0,1|2,0,0]=4 1319 B15R2.31 Cc1ccnc(c1)CN2CCOCC2 34a_100015191051_100000718516 [0,1,0,0,0,1|2,0,0]=4 1320 B15R2.31 Cc1ccnc(c1)CN2CCSCC2 2230a_100000737611_100000718516 [0,1,0,0,0,1|2,0,0]=4 1321 B15R2.31 Cc1ccnc(c1)CN2CCSCC2 269982a_100000737611_100000718516 [0,1,0,0,0,1|2,0,0]=4 1322 B15R2.31 Cc1ccnc(c1)CN2CCSCC2 270004a_100000737611_100011361488 [0,1,0,0,0,1|2,0,0]=4 1323 B15R2.31 Cc1ccnc(n1)NC2CCCCC2 27a_100000182618_100000750684 [0,1,0,0,0,1|2,0,0]=4 1324 B15R2.31 Cc1ccnc(n1)NC2CCOCC2 27a_100000741149_100000750684 [0,1,0,0,0,1|2,0,0]=4 1325 B15R2.31 Cc1ccnc(n1)NC2CCSCC2 27a_100000748639_100000750684 [0,1,0,0,0,1|2,0,0]=4 1326 B15R2.31 Cc1ccnc(n1)SC2CCCCC2 62a_100000210327_100011243806 [0,1,0,0,0,1|2,0,0]=4 1327 B15R2.31 Cc1ccnc(n1)SC2CCCCC2 62a_100011243806_100000210327 [0,1,0,0,0,1|2,0,0]=4 1328 B15R2.31 Cc1ccnc(n1)SC2CCOCC2 62a_100011243806_100011324220 [0,1,0,0,0,1|2,0,0]=4 1329 B15R2.31 Cc1ccnc(n1)SC2CCSCC2 62a_100011243806_100000069128 [0,1,0,0,0,1|2,0,0]=4 1330 B15R2.31 Clc1cccc(n1)CN2CCOCC2 2230a_100015191051_100000086093 [0,1,0,0,0,1|2,0,0]=4 1331 B15R2.31 Clc1cccc(n1)CN2CCOCC2 269982a_100015191051_100000086093 [0,1,0,0,0,1|2,0,0]=4 1332 B15R2.31 Clc1cccc(n1)CN2CCOCC2 270004a_100015191051_100011361687 [0,1,0,0,0,1|2,0,0]=4 1333 B15R2.31 Clc1cccc(n1)CN2CCOCC2 34a_100015191051_100000086093 [0,1,0,0,0,1|2,0,0]=4 1334 B15R2.31 Clc1cccc(n1)CN2CCSCC2 2230a_100000737611_100000086093 [0,1,0,0,0,1|2,0,0]=4 1335 B15R2.31 Clc1cccc(n1)CN2CCSCC2 269982a_100000737611_100000086093 [0,1,0,0,0,1|2,0,0]=4 1336 B15R2.31 Clc1cccc(n1)CN2CCSCC2 270004a_100000737611_100011361687 [0,1,0,0,0,1|2,0,0]=4 1337 B15R2.31 Clc1ccnc(c1)CN2CCOCC2 2230a_100015191051_100016988179 [0,1,0,0,0,1|2,0,0]=4 1338 B15R2.31 Clc1ccnc(c1)CN2CCOCC2 269982a_100015191051_100016988179 [0,1,0,0,0,1|2,0,0]=4 1339 B15R2.31 Clc1ccnc(c1)CN2CCOCC2 270004a_100015191051_100011998288 [0,1,0,0,0,1|2,0,0]=4 1340 B15R2.31 Clc1ccnc(c1)CN2CCOCC2 34a_100015191051_100016988179 [0,1,0,0,0,1|2,0,0]=4 1341 B15R2.31 Clc1ccnc(c1)CN2CCSCC2 2230a_100000737611_100016988179 [0,1,0,0,0,1|2,0,0]=4 1342 B15R2.31 Clc1ccnc(c1)CN2CCSCC2 269982a_100000737611_100016988179 [0,1,0,0,0,1|2,0,0]=4 1343 B15R2.31 Clc1ccnc(c1)CN2CCSCC2 270004a_100000737611_100011998288 [0,1,0,0,0,1|2,0,0]=4 1344 B15R2.31 FC1CCCN(C1)Cc2ccccn2 2230a_100000697950_100000721315 [0,1,0,0,0,1|2,0,0]=4 1345 B15R2.31 FC1CCCN(C1)Cc2ccccn2 269982a_100000697950_100000721315 [0,1,0,0,0,1|2,0,0]=4 1346 B15R2.31 FC1CCCN(C1)Cc2ccccn2 270004a_100000697950_100000209966 [0,1,0,0,0,1|2,0,0]=4 1347 B15R2.31 FC1CCCN(C1)Cc2ccccn2 34a_100000697950_100000721315 [0,1,0,0,0,1|2,0,0]=4 1348 B15R2.31 FC1CCCN(C1)Cc2ncccn2 2230a_100000697950_100000703007 [0,1,0,0,0,1|1,0,0]=3 1349 B15R2.31 FC1CCCN(C1)Cc2ncccn2 269982a_100000697950_100000703007 [0,1,0,0,0,1|1,0,0]=3 1350 B15R2.31 FC1CCCN(C1)Cc2ncccn2 270004a_100000697950_100011532527 [0,1,0,0,0,1|1,0,0]=3 1351 B15R2.31 FC1CCCN(C1)Cc2ncccn2 34a_100000697950_100000703007 [0,1,0,0,0,1|1,0,0]=3 1352 B15R2.31 Fc1cccc(n1)CN2CCOCC2 2230a_100015191051_100009819644 [0,1,0,0,0,1|2,0,0]=4 1353 B15R2.31 Fc1cccc(n1)CN2CCOCC2 269982a_100015191051_100009819644 [0,1,0,0,0,1|2,0,0]=4 1354 B15R2.31 Fc1cccc(n1)CN2CCOCC2 270004a_100015191051_100000050434 [0,1,0,0,0,1|2,0,0]=4 1355 B15R2.31 Fc1cccc(n1)CN2CCOCC2 34a_100015191051_100009819644 [0,1,0,0,0,1|2,0,0]=4 1356 B15R2.31 Fc1cccc(n1)CN2CCSCC2 2230a_100000737611_100009819644 [0,1,0,0,0,1|2,0,0]=4 1357 B15R2.31 Fc1cccc(n1)CN2CCSCC2 269982a_100000737611_100009819644 [0,1,0,0,0,1|2,0,0]=4 1358 B15R2.31 Fc1cccc(n1)CN2CCSCC2 270004a_100000737611_100000050434 [0,1,0,0,0,1|2,0,0]=4 1359 B15R2.31 Nc1ccnc(n1)NC2CCCCC2 27a_100000182618_100000757536 [0,1,0,0,0,1|2,0,0]=4 1360 B15R2.31 Nc1ccnc(n1)NC2CCOCC2 27a_100000741149_100000757536 [0,1,0,0,0,1|2,0,0]=4 1361 B15R2.31 Nc1ccnc(n1)NC2CCSCC2 27a_100000748639_100000757536 [0,1,0,0,0,1|2,0,0]=4 1362 B15R2.31 Nc1ccnc(n1)SC2CCCCC2 62a_100000210327_100000757536 [0,1,0,0,0,1|2,0,0]=4 1363 B15R2.31 Nc1ccnc(n1)SC2CCCCC2 62a_100000757536_100000210327 [0,1,0,0,0,1|2,0,0]=4 1364 B15R2.31 Nc1ccnc(n1)SC2CCOCC2 62a_100000757536_100011324220 [0,1,0,0,0,1|2,0,0]=4 1365 B15R2.31 Nc1ccnc(n1)SC2CCSCC2 62a_100000757536_100000069128 [0,1,0,0,0,1|2,0,0]=4 1366 B15R2.31 O=C1CC(CCN1)Nc2ncccn2 27a_100016994916_100000211032 [0,1,0,0,0,1|1,0,1]=4 1367 B15R2.31 O=C1CN(CCN1)Cc2ccccn2 2230a_100000184651_100000721315 [0,1,0,0,0,1|1,0,1]=4 1368 B15R2.31 O=C1CN(CCN1)Cc2ccccn2 270004a_100000184651_100000209966 [0,1,0,0,0,1|1,0,1]=4 1369 B15R2.31 O=C1CN(CCN1)Cc2ncccn2 2230a_100000184651_100000703007 [0,1,0,0,0,1|0,0,1]=3 1370 B15R2.31 O=C1CN(CCN1)Cc2ncccn2 270004a_100000184651_100011532527 [0,1,0,0,0,1|0,0,1]=3 1371 B15R2.31 O=C1CN(CCO1)Cc2ncccn2 2230a_100000131268_100000703007 [0,1,0,0,0,1|1,0,1]=4 1372 B15R2.31 O=C1CN(CCO1)Cc2ncccn2 270004a_100000131268_100011532527 [0,1,0,0,0,1|1,0,1]=4 1373 B15R2.31 OC1CCCC(C1)Nc2ncccn2 27a_100015190357_100000211032 [0,1,0,0,0,1|2,0,0]=4 1374 B15R2.31 OC1CCCN(C1)Cc2ccccn2 2230a_100000211013_100000721315 [0,1,0,0,0,1|2,0,0]=4 1375 B15R2.31 OC1CCCN(C1)Cc2ccccn2 269982a_100000211013_100000721315 [0,1,0,0,0,1|2,0,0]=4 1376 B15R2.31 OC1CCCN(C1)Cc2ccccn2 270004a_100000211013_100000209966 [0,1,0,0,0,1|2,0,0]=4 1377 B15R2.31 OC1CCCN(C1)Cc2ncccn2 2230a_100000211013_100000703007 [0,1,0,0,0,1|1,0,0]=3 1378 B15R2.31 OC1CCCN(C1)Cc2ncccn2 269982a_100000211013_100000703007 [0,1,0,0,0,1|1,0,0]=3 1379 B15R2.31 OC1CCCN(C1)Cc2ncccn2 270004a_100000211013_100011532527 [0,1,0,0,0,1|1,0,0]=3 1380 B15R2.31 OC1CN(CCO1)Cc2ccccn2 2230a_100000688207_100000721315 [0,1,0,0,0,1|2,0,0]=4 1381 B15R2.31 OC1CN(CCO1)Cc2ccccn2 269982a_100000688207_100000721315 [0,1,0,0,0,1|2,0,0]=4 1382 B15R2.31 OC1CN(CCO1)Cc2ccccn2 270004a_100000688207_100000209966 [0,1,0,0,0,1|2,0,0]=4 1383 B15R2.31 OC1CN(CCO1)Cc2ncccn2 2230a_100000688207_100000703007 [0,1,0,0,0,1|1,0,0]=3 1384 B15R2.31 OC1CN(CCO1)Cc2ncccn2 269982a_100000688207_100000703007 [0,1,0,0,0,1|1,0,0]=3 1385 B15R2.31 OC1CN(CCO1)Cc2ncccn2 270004a_100000688207_100011532527 [0,1,0,0,0,1|1,0,0]=3 1386 B15R2.31 Oc1cccc(n1)OC2CCNCC2 271570a_203496583355_100020638990 [0,1,0,0,0,1|2,0,0]=4 1387 B15R2.31 Oc1ccnc(n1)NC2CCCCC2 27a_100000182618_100011649813 [0,1,0,0,0,1|2,0,0]=4 1388 B15R2.31 Oc1ccnc(n1)NC2CCOCC2 27a_100000741149_100011649813 [0,1,0,0,0,1|2,0,0]=4 1389 B15R2.31 Oc1ccnc(n1)NC2CCSCC2 27a_100000748639_100011649813 [0,1,0,0,0,1|2,0,0]=4 1390 B15R2.31 Oc1ccnc(n1)SC2CCCCC2 62a_100000210327_100011649813 [0,1,0,0,0,1|2,0,0]=4 1391 B15R2.38 Brc1cccnc1CN2CCOCC2 2230a_100015191051_100025702911 [0,1,0,0,0,1|2,0,0]=4 1392 B15R2.38 Brc1cccnc1CN2CCOCC2 270004a_100015191051_100011934733 [0,1,0,0,0,1|2,0,0]=4 1393 B15R2.38 Brc1cccnc1CN2CCOCC2 34a_100015191051_100025702911 [0,1,0,0,0,1|2,0,0]=4 1394 B15R2.38 Brc1cccnc1CN2CCSCC2 2230a_100000737611_100025702911 [0,1,0,0,0,1|2,0,0]=4 1395 B15R2.38 Brc1cccnc1CN2CCSCC2 270004a_100000737611_100011934733 [0,1,0,0,0,1|2,0,0]=4 1396 B15R2.38 CC1CCCCC1Nc2ncccn2 27a_100000211402_100000211032 [0,1,0,0,0,1|2,0,0]=4 1397 B15R2.38 CC1CCCCN1Cc2ccccn2 2230a_100000211376_100000721315 [0,1,0,0,0,1|2,0,0]=4 1398 B15R2.38 CC1CCCCN1Cc2ccccn2 269982a_100000211376_100000721315 [0,1,0,0,0,1|2,0,0]=4 1399 B15R2.38 CC1CCCCN1Cc2ccccn2 270004a_100000211376_100000209966 [0,1,0,0,0,1|2,0,0]=4 1400 B15R2.38 CC1CCCCN1Cc2ccccn2 34a_100000211376_100000721315 [0,1,0,0,0,1|2,0,0]=4 1401 B15R2.38 CC1CCCCN1Cc2ncccn2 2230a_100000211376_100000703007 [0,1,0,0,0,1|1,0,0]=3 1402 B15R2.38 CC1CCCCN1Cc2ncccn2 269982a_100000211376_100000703007 [0,1,0,0,0,1|1,0,0]=3 1403 B15R2.38 CC1CCCCN1Cc2ncccn2 270004a_100000211376_100011532527 [0,1,0,0,0,1|1,0,0]=3 1404 B15R2.38 CC1CCCCN1Cc2ncccn2 34a_100000211376_100000703007 [0,1,0,0,0,1|1,0,0]=3 1405 B15R2.38 C[C@H]1COCCN1Cc2ccccn2 2230a_100009815349_100000721315 [0,1,0,0,0,1|2,0,0]=4 1406 B15R2.38 C[C@H]1COCCN1Cc2ccccn2 269982a_100009815349_100000721315 [0,1,0,0,0,1|2,0,0]=4 1407 B15R2.38 C[C@H]1COCCN1Cc2ccccn2 270004a_100009815349_100000209966 [0,1,0,0,0,1|2,0,0]=4 1408 B15R2.38 C[C@H]1COCCN1Cc2ccccn2 34a_100009815349_100000721315 [0,1,0,0,0,1|2,0,0]=4 1409 B15R2.38 C[C@H]1COCCN1Cc2ncccn2 2230a_100009815349_100000703007 [0,1,0,0,0,1|1,0,0]=3 1410 B15R2.38 C[C@H]1COCCN1Cc2ncccn2 269982a_100009815349_100000703007 [0,1,0,0,0,1|1,0,0]=3 1411 B15R2.38 C[C@H]1COCCN1Cc2ncccn2 270004a_100009815349_100011532527 [0,1,0,0,0,1|1,0,0]=3 1412 B15R2.38 C[C@H]1COCCN1Cc2ncccn2 34a_100009815349_100000703007 [0,1,0,0,0,1|1,0,0]=3 1413 B15R2.38 Cc1cccnc1CN2CCOCC2 2230a_100015191051_100000696600 [0,1,0,0,0,1|2,0,0]=4 1414 B15R2.38 Cc1cccnc1CN2CCOCC2 269982a_100015191051_100000696600 [0,1,0,0,0,1|2,0,0]=4 1415 B15R2.38 Cc1cccnc1CN2CCOCC2 270004a_100015191051_100000698913 [0,1,0,0,0,1|2,0,0]=4 1416 B15R2.38 Cc1cccnc1CN2CCOCC2 34a_100015191051_100000696600 [0,1,0,0,0,1|2,0,0]=4 1417 B15R2.38 Cc1cccnc1CN2CCSCC2 2230a_100000737611_100000696600 [0,1,0,0,0,1|2,0,0]=4 1418 B15R2.38 Cc1cccnc1CN2CCSCC2 269982a_100000737611_100000696600 [0,1,0,0,0,1|2,0,0]=4 1419 B15R2.38 Cc1cccnc1CN2CCSCC2 270004a_100000737611_100000698913 [0,1,0,0,0,1|2,0,0]=4 1420 B15R2.38 Clc1cccnc1CN2CCOCC2 2230a_100015191051_100000099807 [0,1,0,0,0,1|2,0,0]=4 1421 B15R2.38 Clc1cccnc1CN2CCOCC2 269982a_100015191051_100000099807 [0,1,0,0,0,1|2,0,0]=4 1422 B15R2.38 Clc1cccnc1CN2CCOCC2 270004a_100015191051_100012001307 [0,1,0,0,0,1|2,0,0]=4 1423 B15R2.38 Clc1cccnc1CN2CCSCC2 2230a_100000737611_100000099807 [0,1,0,0,0,1|2,0,0]=4 1424 B15R2.38 Clc1cccnc1CN2CCSCC2 269982a_100000737611_100000099807 [0,1,0,0,0,1|2,0,0]=4 1425 B15R2.38 Clc1cccnc1CN2CCSCC2 270004a_100000737611_100012001307 [0,1,0,0,0,1|2,0,0]=4 1426 B15R2.38 FC1CCCCC1Sc2ncccn2 62a_100000211032_100015423560 [0,1,0,0,0,1|2,0,0]=4 1427 B15R2.38 FC1CCCCC1Sc2ncccn2 62a_100015423560_100000211032 [0,1,0,0,0,1|2,0,0]=4 1428 B15R2.38 F[C@@H]1CCCC[C@H]1Nc2ncccn2 27a_100015195156_100000211032 [0,1,0,0,0,1|2,0,0]=4 1429 B15R2.38 F[C@H]1COCC[C@@H]1Nc2ncccn2 27a_100016994078_100000211032 [0,1,0,0,0,1|2,0,0]=4 1430 B15R2.38 Fc1cccnc1CN2CCOCC2 2230a_100015191051_100000104219 [0,1,0,0,0,1|2,0,0]=4 1431 B15R2.38 Fc1cccnc1CN2CCOCC2 269982a_100015191051_100000104219 [0,1,0,0,0,1|2,0,0]=4 1432 B15R2.38 Fc1cccnc1CN2CCOCC2 270004a_100015191051_100011934734 [0,1,0,0,0,1|2,0,0]=4 1433 B15R2.38 Fc1cccnc1CN2CCOCC2 34a_100015191051_100000104219 [0,1,0,0,0,1|2,0,0]=4 1434 B15R2.38 Fc1cccnc1CN2CCSCC2 2230a_100000737611_100000104219 [0,1,0,0,0,1|2,0,0]=4 1435 B15R2.38 Fc1cccnc1CN2CCSCC2 269982a_100000737611_100000104219 [0,1,0,0,0,1|2,0,0]=4 1436 B15R2.38 Fc1cccnc1CN2CCSCC2 270004a_100000737611_100011934734 [0,1,0,0,0,1|2,0,0]=4 1437 B15R2.38 OC1CCCCC1Sc2ncccn2 62a_100000038908_100000211032 [0,1,0,0,0,1|2,0,0]=4 1438 B15R2.38 OC1CCCCC1Sc2ncccn2 62a_100000211032_100000038908 [0,1,0,0,0,1|2,0,0]=4 1439 B15R2.38 O[C@H]1CCCC[C@H]1Nc2ncccn2 27a_100015191688_100000211032 [0,1,0,0,0,1|2,0,0]=4 1440 B15R2.38 O[C@H]1COCC[C@H]1Nc2ncccn2 27a_100016994285_100000211032 [0,1,0,0,0,1|2,0,0]=4 1441 B15R2.38 Oc1ccccc1CN2CCNCC2 271570a_203496583355_100015186962 [0,1,0,0,0,1|2,0,0]=4 1442 B15R2.38 Oc1cccnc1CN2CCOCC2 34a_100015191051_200020655725 [0,1,0,0,0,1|2,0,0]=4 1443 B15R2.2226 CC(c1ncccn1)N2CC=CCC2 270004a_100000698166_100011350828 [0,1,0,0,0,1|1,0,1]=4 1444 B15R2.2226 CC(c1ncccn1)N2CCCOC2 270004a_100000131196_100011350828 [0,1,0,0,0,1|2,0,0]=4 1445 B15R2.2226 CC(c1ncccn1)N2CCOCC2 270004a_100015191051_100011350828 [0,1,0,0,0,1|1,0,0]=3 1446 B15R2.2226 CC(c1ncccn1)N2CCSCC2 270004a_100000737611_100011350828 [0,1,0,0,0,1|1,0,0]=3 1447 B15R2.2226 CN(c1ncccn1)C2CCCCC2 27a_100000207522_100000211032 [0,1,0,0,0,1|2,0,0]=4 1448 B15R2.2226 CN(c1ncccn1)C2CCOCC2 27a_100020587155_100000211032 [0,1,0,0,0,1|2,0,0]=4 1449 B15R2.2226 CN(c1ncccn1)C2CCSCC2 27a_100015184757_100000211032 [0,1,0,0,0,1|2,0,0]=4 1450 B15R2.7956 CC1(CCOCC1)Nc2ncccn2 27a_100000692449_100000211032 [0,1,0,0,0,1|2,0,0]=4 1451 B15R2.543 O=C1CN(CCCN1)c2ncccn2 27a_100015190381_100000211032 [0,1,0,0,0,1|0,0,1]=3 1452 B15R2.543 OC1CCCCN(C1)c2ncccn2 27a_100025706797_100000211032 [0,1,0,0,0,1|1,0,0]=3 1453 B15R2.543 O[C@H]1COCCN(C1)c2ncccn2 27a_100016073750_100000211032 [0,1,0,0,0,1|1,0,0]=3 1454 B15R2.548 CC1CCCN(CC1)c2ncccn2 27a_100025706717_100000211032 [0,1,0,0,0,1|1,0,0]=3 1455 B15R2.548 CN1CCCN(CC1)c2ccccn2 2230a_100102579498_200000210301 [0,1,0,0,0,1|1,0,0]=3 1456 B15R2.548 CN1CCCN(CC1)c2ccccn2 269982a_100102579498_200000210301 [0,1,0,0,0,1|1,0,0]=3 1457 B15R2.548 CN1CCCN(CC1)c2cccnn2 27a_100000211313_100016991348 [0,1,0,0,0,1|2,0,0]=4 1458 B15R2.548 CN1CCCN(CC1)c2ccncn2 27a_100000211313_100000703185 [0,1,0,0,0,1|2,0,0]=4 1459 B15R2.548 CN1CCCN(CC1)c2cnccn2 2230a_114873767175_200000210301 [0,1,0,0,0,1|2,0,0]=4 1460 B15R2.548 CN1CCCN(CC1)c2cnccn2 269982a_114873767175_200000210301 [0,1,0,0,0,1|2,0,0]=4 1461 B15R2.548 CN1CCCN(CC1)c2cnccn2 27a_100000211313_100000211759 [0,1,0,0,0,1|2,0,0]=4 1462 B15R2.548 CN1CCCN(CC1)c2ncccn2 2230a_100000751353_200000210301 [0,1,0,0,0,1|0,0,0]=2 1463 B15R2.548 CN1CCCN(CC1)c2ncccn2 269982a_100000751353_200000210301 [0,1,0,0,0,1|0,0,0]=2 1464 B15R2.548 CN1CCCN(CC1)c2ncccn2 27a_100000211313_100000211032 [0,1,0,0,0,1|0,0,0]=2 1465 B15R2.548 O=C1CCN(CCN1)c2cccnn2 27a_100000698595_100016991348 [0,1,0,0,0,1|2,0,0]=4 1466 B15R2.548 O=C1CCN(CCN1)c2ccncn2 27a_100000698595_100000703185 [0,1,0,0,0,1|2,0,0]=4 1467 B15R2.548 O=C1CCN(CCN1)c2cnccn2 27a_100000698595_100000211759 [0,1,0,0,0,1|2,0,0]=4 1468 B15R2.548 O=C1CCN(CCN1)c2ncccn2 27a_100000698595_100000211032 [0,1,0,0,0,1|0,0,0]=2 1469 B15R2.548 OC1CCCN(CC1)c2ncccn2 27a_100015186869_100000211032 [0,1,0,0,0,1|1,0,0]=3 1470 B15R2.548 [13CH3]N1CCCN(CC1)c2ccccn2 2230a_100102579498_200025704644 [0,1,0,0,0,1|1,0,0]=3 1471 B15R2.548 [13CH3]N1CCCN(CC1)c2ccccn2 269982a_100102579498_200025704644 [0,1,0,0,0,1|1,0,0]=3 1472 B15R2.548 [13CH3]N1CCCN(CC1)c2cnccn2 2230a_114873767175_200025704644 [0,1,0,0,0,1|2,0,0]=4 1473 B15R2.548 [13CH3]N1CCCN(CC1)c2cnccn2 269982a_114873767175_200025704644 [0,1,0,0,0,1|2,0,0]=4 1474 B15R2.548 [13CH3]N1CCCN(CC1)c2ncccn2 2230a_100000751353_200025704644 [0,1,0,0,0,1|0,0,0]=2 1475 B15R2.548 [13CH3]N1CCCN(CC1)c2ncccn2 269982a_100000751353_200025704644 [0,1,0,0,0,1|0,0,0]=2 1476 B15R2.6968 Brc1ccc(nc1)N2CCCCCC2 27a_100000185865_100000686858 [0,1,0,0,0,1|2,0,0]=4 1477 B15R2.6968 Brc1ccc(nc1)N2CCCOCC2 27a_100000685342_100000686858 [0,1,0,0,0,1|2,0,0]=4 1478 B15R2.6968 Brc1cnc(nc1)C2=CCCCCC2 271570a_200009888920_100000690281 [0,1,0,0,0,1|2,0,0]=4 1479 B15R2.6968 Brc1cnc(nc1)N2CCCCCC2 27a_100000185865_100000690281 [0,1,0,0,0,1|1,0,0]=3 1480 B15R2.6968 Brc1cnc(nc1)N2CCCOCC2 27a_100000685342_100000690281 [0,1,0,0,0,1|1,0,0]=3 1481 B15R2.6968 Cc1cnc(nc1)C2=CCCCCC2 271570a_200009888920_100011825175 [0,1,0,0,0,1|2,0,0]=4 1482 B15R2.6968 Cc1cnc(nc1)N2CCCCCC2 27a_100000185865_100000061069 [0,1,0,0,0,1|1,0,0]=3 1483 B15R2.6968 Cc1cnc(nc1)N2CCCOCC2 27a_100000685342_100000061069 [0,1,0,0,0,1|1,0,0]=3 1484 B15R2.6968 Clc1cnc(nc1)C2=CCCCCC2 271570a_200009888920_100011356929 [0,1,0,0,0,1|2,0,0]=4 1485 B15R2.6968 Clc1cnc(nc1)N2CCCCCC2 27a_100000185865_100011356929 [0,1,0,0,0,1|1,0,0]=3 1486 B15R2.6968 Clc1cnc(nc1)N2CCCOCC2 27a_100000685342_100011356929 [0,1,0,0,0,1|1,0,0]=3 1487 B15R2.6968 Fc1cnc(nc1)C2=CCCCCC2 271570a_200009888920_100000685220 [0,1,0,0,0,1|2,0,0]=4 1488 B15R2.6968 Fc1cnc(nc1)N2CCCCCC2 27a_100000185865_100000685220 [0,1,0,0,0,1|1,0,0]=3 1489 B15R2.6968 Fc1cnc(nc1)N2CCCOCC2 27a_100000685342_100000685220 [0,1,0,0,0,1|1,0,0]=3 1490 B15R2.6968 Nc1cnc(nc1)C2=CCCCCC2 271570a_200009888920_100000068403 [0,1,0,0,0,1|2,0,0]=4 1491 B15R2.6968 Oc1cnc(nc1)C2=CCCCCC2 271570a_200009888920_100000730009 [0,1,0,0,0,1|2,0,0]=4 1492 B15R2.6968 Oc1cnc(nc1)N2CCCNCC2 271570a_203496583355_200011216447 [0,1,0,0,0,1|0,0,0]=2 1493 B15R2.7124 Cc1ccnc(n1)C2=CCCCCC2 271570a_200009888920_100011243806 [0,1,0,0,0,1|2,0,0]=4 1494 B15R2.7124 Cc1ccnc(n1)N2CCCCCC2 27a_100000185865_100000750684 [0,1,0,0,0,1|1,0,0]=3 1495 B15R2.7124 Cc1ccnc(n1)N2CCCOCC2 27a_100000685342_100000750684 [0,1,0,0,0,1|1,0,0]=3 1496 B15R2.7124 Fc1cccc(n1)N2CCCCCC2 27a_100000185865_100009815982 [0,1,0,0,0,1|2,0,0]=4 1497 B15R2.7124 Fc1cccc(n1)N2CCCOCC2 27a_100000685342_100009815982 [0,1,0,0,0,1|2,0,0]=4 1498 B15R2.7124 Fc1ccnc(c1)N2CCCCCC2 27a_100000185865_100000764206 [0,1,0,0,0,1|2,0,0]=4 1499 B15R2.7124 Fc1ccnc(c1)N2CCCOCC2 27a_100000685342_100000764206 [0,1,0,0,0,1|2,0,0]=4 1500 B15R2.7124 Nc1ccnc(n1)C2=CCCCCC2 271570a_200009888920_100000757536 [0,1,0,0,0,1|2,0,0]=4 1501 B15R2.7124 Nc1ccnc(n1)N2CCCCCC2 27a_100000185865_100000757536 [0,1,0,0,0,1|1,0,0]=3 1502 B15R2.7124 Nc1ccnc(n1)N2CCCOCC2 27a_100000685342_100000757536 [0,1,0,0,0,1|1,0,0]=3 1503 B15R2.7124 Nc1ncnc(n1)N2CCCCCC2 27a_100000185865_100000123831 [0,1,0,0,0,1|2,0,0]=4 1504 B15R2.7124 Nc1ncnc(n1)N2CCCOCC2 27a_100000685342_100000123831 [0,1,0,0,0,1|2,0,0]=4 1505 B15R2.7124 Oc1ccnc(n1)C2=CCCCCC2 271570a_200009888920_100011649813 [0,1,0,0,0,1|2,0,0]=4 1506 B15R2.7124 Oc1ccnc(n1)N2CCCCCC2 27a_100000185865_100011649813 [0,1,0,0,0,1|1,0,0]=3 1507 B15R2.7124 Oc1ccnc(n1)N2CCCOCC2 27a_100000685342_100011649813 [0,1,0,0,0,1|1,0,0]=3 1508 B15R2.8789 Brc1cccnc1N2CCCCCC2 27a_100000185865_100000696092 [0,1,0,0,0,1|2,0,0]=4 1509 B15R2.8789 Brc1cccnc1N2CCCOCC2 27a_100000685342_100000696092 [0,1,0,0,0,1|2,0,0]=4 1510 B15R2.17 C#CC1CCCN(C1)c2ncccn2 27a_100015191679_100000211032 [0,2,0,0,0,0|1,0,0]=3 1511 B15R2.17 C=Cc1cc(ncn1)N2CCNCC2 271570a_100011290941_100000757499 [0,2,0,0,0,0|2,0,0]=4 1512 B15R2.17 C=Cc1cccc(c1)N2CCNCC2 271570a_100011290941_100000729370 [0,2,0,0,0,0|2,0,0]=4 1513 B15R2.17 C=Cc1cccc(n1)N2CCCCC2 271570a_100011290941_200011934742 [0,2,0,0,0,0|2,0,0]=4 1514 B15R2.17 C=Cc1cccc(n1)N2CCNCC2 271570a_100011290941_100000741847 [0,2,0,0,0,0|1,0,0]=3 1515 B15R2.17 C=Cc1cccc(n1)N2CCOCC2 271570a_100011290941_100011934752 [0,2,0,0,0,0|2,0,0]=4 1516 B15R2.17 C=Cc1ccnc(c1)N2CCCCC2 271570a_100011290941_100000100308 [0,2,0,0,0,0|2,0,0]=4 1517 B15R2.17 C=Cc1ccnc(c1)N2CCNCC2 271570a_100011290941_100025705765 [0,2,0,0,0,0|1,0,0]=3 1518 B15R2.17 C=Cc1ccnc(c1)N2CCOCC2 271570a_100011290941_100000732431 [0,2,0,0,0,0|2,0,0]=4 1519 B15R2.17 C=Cc1ccnc(n1)N2CCNCC2 271570a_100011290941_200020587174 [0,2,0,0,0,0|0,0,0]=2 1520 B15R2.17 C=Cc1ccnc(n1)N2CCOCC2 271570a_100011290941_100000697286 [0,2,0,0,0,0|1,0,0]=3 1521 B15R2.17 C=Cc1cncc(n1)N2CCNCC2 271570a_100011290941_200015191129 [0,2,0,0,0,0|2,0,0]=4 1522 B15R2.17 CCC1CN(CCO1)c2ncccn2 27a_100000736320_100000211032 [0,2,0,0,0,0|1,0,0]=3 1523 B15R2.17 CCc1ccnc(c1)N2CCOCC2 27a_100015191051_100009817561 [0,2,0,0,0,0|2,0,0]=4 1524 B15R2.17 CCc1ccnc(c1)N2CCSCC2 27a_100000737611_100009817561 [0,2,0,0,0,0|2,0,0]=4 1525 B15R2.17 CCc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100000100215 [0,2,0,0,0,0|1,0,1]=4 1526 B15R2.17 CCc1ccnc(n1)N2CC=CCC2 27a_100000698166_100000100215 [0,2,0,0,0,0|1,0,1]=4 1527 B15R2.17 CCc1ccnc(n1)N2CCOCC2 27a_100015191051_100000100215 [0,2,0,0,0,0|1,0,0]=3 1528 B15R2.17 CCc1ccnc(n1)N2CCSCC2 27a_100000737611_100000100215 [0,2,0,0,0,0|1,0,0]=3 1529 B15R2.17 CNC1CCCN(C1)c2ncccn2 2230a_100000741142_200000210301 [0,2,0,0,0,0|1,0,0]=3 1530 B15R2.17 CNc1cc(ncn1)N2CCNCC2 27a_100102657272_100000757499 [0,2,0,0,0,0|2,0,0]=4 1531 B15R2.17 CNc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100011649947 [0,2,0,0,0,0|1,0,1]=4 1532 B15R2.17 CNc1ccnc(n1)N2CC=CCC2 27a_100000698166_100011649947 [0,2,0,0,0,0|1,0,1]=4 1533 B15R2.17 CNc1ccnc(n1)N2CCNCC2 27a_100102657272_200020587174 [0,2,0,0,0,0|0,0,0]=2 1534 B15R2.17 CNc1ccnc(n1)N2CCOCC2 27a_100015191051_100011649947 [0,2,0,0,0,0|1,0,0]=3 1535 B15R2.17 CNc1ccnc(n1)N2CCOCC2 27a_100102657272_100000697286 [0,2,0,0,0,0|1,0,0]=3 1536 B15R2.17 CNc1ccnc(n1)N2CCSCC2 27a_100000737611_100011649947 [0,2,0,0,0,0|1,0,0]=3 1537 B15R2.17 COC1CCCN(C1)c2ncccn2 27a_100000695604_100000211032 [0,2,0,0,0,0|1,0,0]=3 1538 B15R2.17 COc1cccc(c1)N2CCNCC2 34a_100000217334_200000210301 [0,2,0,0,0,0|2,0,0]=4 1539 B15R2.17 COc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100000182009 [0,2,0,0,0,0|1,0,1]=4 1540 B15R2.17 COc1ccnc(n1)N2CC=CCC2 27a_100000698166_100000182009 [0,2,0,0,0,0|1,0,1]=4 1541 B15R2.17 COc1ccnc(n1)N2CCOCC2 27a_100015191051_100000182009 [0,2,0,0,0,0|1,0,0]=3 1542 B15R2.17 COc1ccnc(n1)N2CCSCC2 27a_100000737611_100000182009 [0,2,0,0,0,0|1,0,0]=3 1543 B15R2.17 COc1ncnc(n1)N2CCOCC2 27a_100015191051_200010750123 [0,2,0,0,0,0|2,0,0]=4 1544 B15R2.17 COc1ncnc(n1)N2CCSCC2 27a_100000737611_200010750123 [0,2,0,0,0,0|2,0,0]=4 1545 B15R2.17 CSc1cc(ncn1)N2CCNCC2 62a_100000757499_200000210301 [0,2,0,0,0,0|2,0,0]=4 1546 B15R2.17 CSc1cc(ncn1)N2CCNCC2 62a_200000210301_100000757499 [0,2,0,0,0,0|2,0,0]=4 1547 B15R2.17 CSc1cccc(c1)N2CCNCC2 62a_100000729370_200000210301 [0,2,0,0,0,0|2,0,0]=4 1548 B15R2.17 CSc1cccc(c1)N2CCNCC2 62a_200000210301_100000729370 [0,2,0,0,0,0|2,0,0]=4 1549 B15R2.17 CSc1cccc(n1)N2CCCCC2 62a_200000210301_200011934742 [0,2,0,0,0,0|2,0,0]=4 1550 B15R2.17 CSc1cccc(n1)N2CCCCC2 62a_200011934742_200000210301 [0,2,0,0,0,0|2,0,0]=4 1551 B15R2.17 CSc1cccc(n1)N2CCNCC2 62a_100000741847_200000210301 [0,2,0,0,0,0|1,0,0]=3 1552 B15R2.17 CSc1cccc(n1)N2CCNCC2 62a_200000210301_100000741847 [0,2,0,0,0,0|1,0,0]=3 1553 B15R2.17 CSc1cccc(n1)N2CCOCC2 62a_100011934752_200000210301 [0,2,0,0,0,0|2,0,0]=4 1554 B15R2.17 CSc1cccc(n1)N2CCOCC2 62a_200000210301_100011934752 [0,2,0,0,0,0|2,0,0]=4 1555 B15R2.17 CSc1ccnc(c1)N2CCCCC2 62a_100000100308_200000210301 [0,2,0,0,0,0|2,0,0]=4 1556 B15R2.17 CSc1ccnc(c1)N2CCCCC2 62a_200000210301_100000100308 [0,2,0,0,0,0|2,0,0]=4 1557 B15R2.17 CSc1ccnc(c1)N2CCNCC2 62a_100025705765_200000210301 [0,2,0,0,0,0|1,0,0]=3 1558 B15R2.17 CSc1ccnc(c1)N2CCNCC2 62a_200000210301_100025705765 [0,2,0,0,0,0|1,0,0]=3 1559 B15R2.17 CSc1ccnc(c1)N2CCOCC2 62a_100000732431_200000210301 [0,2,0,0,0,0|2,0,0]=4 1560 B15R2.17 CSc1ccnc(c1)N2CCOCC2 62a_200000210301_100000732431 [0,2,0,0,0,0|2,0,0]=4 1561 B15R2.17 CSc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100011650323 [0,2,0,0,0,0|1,0,1]=4 1562 B15R2.17 CSc1ccnc(n1)N2CC=CCC2 27a_100000698166_100011650323 [0,2,0,0,0,0|1,0,1]=4 1563 B15R2.17 CSc1ccnc(n1)N2CCNCC2 62a_200000210301_200020587174 [0,2,0,0,0,0|0,0,0]=2 1564 B15R2.17 CSc1ccnc(n1)N2CCNCC2 62a_200020587174_200000210301 [0,2,0,0,0,0|0,0,0]=2 1565 B15R2.17 CSc1ccnc(n1)N2CCOCC2 27a_100015191051_100011650323 [0,2,0,0,0,0|1,0,0]=3 1566 B15R2.17 CSc1ccnc(n1)N2CCOCC2 62a_100000697286_200000210301 [0,2,0,0,0,0|1,0,0]=3 1567 B15R2.17 CSc1ccnc(n1)N2CCOCC2 62a_200000210301_100000697286 [0,2,0,0,0,0|1,0,0]=3 1568 B15R2.17 CSc1ccnc(n1)N2CCSCC2 27a_100000737611_100011650323 [0,2,0,0,0,0|1,0,0]=3 1569 B15R2.17 CSc1cncc(n1)N2CCNCC2 62a_200000210301_200015191129 [0,2,0,0,0,0|2,0,0]=4 1570 B15R2.17 CSc1cncc(n1)N2CCNCC2 62a_200015191129_200000210301 [0,2,0,0,0,0|2,0,0]=4 1571 B15R2.17 FCC1CCCN(C1)c2ncccn2 27a_100016992999_100000211032 [0,2,0,0,0,0|1,0,0]=3 1572 B15R2.17 N#CC1CCCN(C1)c2ncccn2 27a_100016989302_100000211032 [0,2,0,0,0,0|1,0,0]=3 1573 B15R2.17 N#CC1CN(CCO1)c2ncccn2 27a_100000752543_100000211032 [0,2,0,0,0,0|1,0,0]=3 1574 B15R2.17 N#Cc1cccc(n1)N2CCOCC2 27a_100015191051_100011934037 [0,2,0,0,0,0|2,0,0]=4 1575 B15R2.17 N#Cc1cccc(n1)N2CCSCC2 27a_100000737611_100011934037 [0,2,0,0,0,0|2,0,0]=4 1576 B15R2.17 N#Cc1ccnc(c1)N2CCOCC2 27a_100015191051_100011291639 [0,2,0,0,0,0|2,0,0]=4 1577 B15R2.17 N#Cc1ccnc(c1)N2CCSCC2 27a_100000737611_100011291639 [0,2,0,0,0,0|2,0,0]=4 1578 B15R2.17 N#Cc1ccnc(n1)C2=CCNCC2 271570a_100000731432_100000066186 [0,2,0,0,0,0|1,0,1]=4 1579 B15R2.17 N#Cc1ccnc(n1)N2CC=CCC2 27a_100000698166_100000066186 [0,2,0,0,0,0|1,0,1]=4 1580 B15R2.17 N#Cc1ccnc(n1)N2CCOCC2 27a_100015191051_100000066186 [0,2,0,0,0,0|1,0,0]=3 1581 B15R2.17 N#Cc1ccnc(n1)N2CCSCC2 27a_100000737611_100000066186 [0,2,0,0,0,0|1,0,0]=3 1582 B15R2.17 OCC1CCCN(C1)c2ncccn2 27a_100000211344_100000211032 [0,2,0,0,0,0|1,0,0]=3 1583 B15R2.17 OC[C@@H]1CN(CCO1)c2ncccn2 27a_100015189573_100000211032 [0,2,0,0,0,0|1,0,0]=3 1584 B15R2.17 [13CH3]NC1CCCN(C1)c2ncccn2 2230a_100000741142_200025704644 [0,2,0,0,0,0|1,0,0]=3 1585 B15R2.17 [13CH3]Oc1cccc(c1)N2CCNCC2 34a_100000217334_200025704644 [0,2,0,0,0,0|2,0,0]=4 1586 B15R2.17 [13CH3]Sc1cc(ncn1)N2CCNCC2 62a_100000757499_200025704644 [0,2,0,0,0,0|2,0,0]=4 1587 B15R2.17 [13CH3]Sc1cc(ncn1)N2CCNCC2 62a_200025704644_100000757499 [0,2,0,0,0,0|2,0,0]=4 1588 B15R2.17 [13CH3]Sc1cccc(c1)N2CCNCC2 62a_100000729370_200025704644 [0,2,0,0,0,0|2,0,0]=4 1589 B15R2.17 [13CH3]Sc1cccc(c1)N2CCNCC2 62a_200025704644_100000729370 [0,2,0,0,0,0|2,0,0]=4 1590 B15R2.17 [13CH3]Sc1cccc(n1)N2CCCCC2 62a_200011934742_200025704644 [0,2,0,0,0,0|2,0,0]=4 1591 B15R2.17 [13CH3]Sc1cccc(n1)N2CCCCC2 62a_200025704644_200011934742 [0,2,0,0,0,0|2,0,0]=4 1592 B15R2.17 [13CH3]Sc1cccc(n1)N2CCNCC2 62a_100000741847_200025704644 [0,2,0,0,0,0|1,0,0]=3 1593 B15R2.17 [13CH3]Sc1cccc(n1)N2CCNCC2 62a_200025704644_100000741847 [0,2,0,0,0,0|1,0,0]=3 1594 B15R2.17 [13CH3]Sc1cccc(n1)N2CCOCC2 62a_100011934752_200025704644 [0,2,0,0,0,0|2,0,0]=4 1595 B15R2.17 [13CH3]Sc1cccc(n1)N2CCOCC2 62a_200025704644_100011934752 [0,2,0,0,0,0|2,0,0]=4 1596 B15R2.17 [13CH3]Sc1ccnc(c1)N2CCCCC2 62a_100000100308_200025704644 [0,2,0,0,0,0|2,0,0]=4 1597 B15R2.17 [13CH3]Sc1ccnc(c1)N2CCCCC2 62a_200025704644_100000100308 [0,2,0,0,0,0|2,0,0]=4 1598 B15R2.17 [13CH3]Sc1ccnc(c1)N2CCNCC2 62a_100025705765_200025704644 [0,2,0,0,0,0|1,0,0]=3 1599 B15R2.17 [13CH3]Sc1ccnc(c1)N2CCNCC2 62a_200025704644_100025705765 [0,2,0,0,0,0|1,0,0]=3 1600 B15R2.17 [13CH3]Sc1ccnc(c1)N2CCOCC2 62a_100000732431_200025704644 [0,2,0,0,0,0|2,0,0]=4 1601 B15R2.17 [13CH3]Sc1ccnc(c1)N2CCOCC2 62a_200025704644_100000732431 [0,2,0,0,0,0|2,0,0]=4 1602 B15R2.17 [13CH3]Sc1ccnc(n1)N2CCNCC2 62a_200020587174_200025704644 [0,2,0,0,0,0|0,0,0]=2 1603 B15R2.17 [13CH3]Sc1ccnc(n1)N2CCNCC2 62a_200025704644_200020587174 [0,2,0,0,0,0|0,0,0]=2 1604 B15R2.17 [13CH3]Sc1ccnc(n1)N2CCOCC2 62a_100000697286_200025704644 [0,2,0,0,0,0|1,0,0]=3 1605 B15R2.17 [13CH3]Sc1ccnc(n1)N2CCOCC2 62a_200025704644_100000697286 [0,2,0,0,0,0|1,0,0]=3 1606 B15R2.17 [13CH3]Sc1cncc(n1)N2CCNCC2 62a_200015191129_200025704644 [0,2,0,0,0,0|2,0,0]=4 1607 B15R2.17 [13CH3]Sc1cncc(n1)N2CCNCC2 62a_200025704644_200015191129 [0,2,0,0,0,0|2,0,0]=4 1608 B15R2.27 CC1CC(CN(C1)c2ncccn2)C 27a_100000210448_100000211032 [0,2,0,0,0,0|1,0,0]=3 1609 B15R2.27 CC1CN(CC(O1)C)c2ncccn2 27a_100000210032_100000211032 [0,2,0,0,0,0|1,0,0]=3 1610 B15R2.27 Cc1cc(nc(c1)N2CCOCC2)C 27a_100015191051_100000069240 [0,2,0,0,0,0|2,0,0]=4 1611 B15R2.27 Cc1cc(nc(c1)N2CCOCC2)F 27a_100015191051_100009819601 [0,2,0,0,0,0|2,0,0]=4 1612 B15R2.27 Cc1cc(nc(c1)N2CCSCC2)C 27a_100000737611_100000069240 [0,2,0,0,0,0|2,0,0]=4 1613 B15R2.27 Cc1cc(nc(c1)N2CCSCC2)F 27a_100000737611_100009819601 [0,2,0,0,0,0|2,0,0]=4 1614 B15R2.27 Cc1cc(nc(n1)C2=CCNCC2)C 271570a_100000731432_100000736147 [0,2,0,0,0,0|1,0,1]=4 1615 B15R2.27 Cc1cc(nc(n1)C2=CCNCC2)N 271570a_100000731432_100000687285 [0,2,0,0,0,0|1,0,1]=4 1616 B15R2.27 Cc1cc(nc(n1)N2CC=CCC2)C 27a_100000698166_100000736147 [0,2,0,0,0,0|1,0,1]=4 1617 B15R2.27 Cc1cc(nc(n1)N2CC=CCC2)N 27a_100000698166_100000687285 [0,2,0,0,0,0|1,0,1]=4 1618 B15R2.27 Cc1cc(nc(n1)N2CCCCC2)O 271570a_203496583355_200011202812 [0,2,0,0,0,0|1,0,0]=3 1619 B15R2.27 Cc1cc(nc(n1)N2CCOCC2)C 27a_100015191051_100000736147 [0,2,0,0,0,0|1,0,0]=3 1620 B15R2.27 Cc1cc(nc(n1)N2CCOCC2)N 27a_100015191051_100000687285 [0,2,0,0,0,0|1,0,0]=3 1621 B15R2.27 Cc1cc(nc(n1)N2CCOCC2)O 271570a_203496583355_200011202816 [0,2,0,0,0,0|1,0,0]=3 1622 B15R2.27 Cc1cc(nc(n1)N2CCSCC2)C 27a_100000737611_100000736147 [0,2,0,0,0,0|1,0,0]=3 1623 B15R2.27 Cc1cc(nc(n1)N2CCSCC2)N 27a_100000737611_100000687285 [0,2,0,0,0,0|1,0,0]=3 1624 B15R2.27 Cc1nc(nc(n1)N2CCOCC2)C 27a_100015191051_100015468570 [0,2,0,0,0,0|2,0,0]=4 1625 B15R2.27 Cc1nc(nc(n1)N2CCOCC2)N 27a_100015191051_200012022553 [0,2,0,0,0,0|2,0,0]=4 1626 B15R2.27 Cc1nc(nc(n1)N2CCSCC2)C 27a_100000737611_100015468570 [0,2,0,0,0,0|2,0,0]=4 1627 B15R2.27 Cc1nc(nc(n1)N2CCSCC2)N 27a_100000737611_200012022553 [0,2,0,0,0,0|2,0,0]=4 1628 B15R2.27 Nc1cc(=O)nc([nH]1)N2CCOCC2 27a_100015191051_100000101444 [0,2,0,0,0,0|1,0,1]=4 1629 B15R2.27 Nc1cc(=O)nc([nH]1)N2CCSCC2 27a_100000737611_100000101444 [0,2,0,0,0,0|1,0,1]=4 1630 B15R2.27 Nc1cc(nc(n1)N2CCOCC2)O 271570a_203496583355_100000069683 [0,2,0,0,0,0|1,0,0]=3 1631 B15R2.27 Nc1nc(nc(n1)N2CCOCC2)N 27a_100015191051_100000188858 [0,2,0,0,0,0|2,0,0]=4 1632 B15R2.27 Nc1nc(nc(n1)N2CCSCC2)N 27a_100000737611_100000188858 [0,2,0,0,0,0|2,0,0]=4 1633 B15R2.27 Oc1cc(cc(c1)N2CCNCC2)F 271570a_203496583355_100138413759 [0,2,0,0,0,0|2,0,0]=4 1634 B15R2.28 C=C1CCN(CC1)c2cc(ccn2)F 27a_100000752442_100000764206 [0,2,0,0,0,0|2,0,0]=4 1635 B15R2.28 C=C1CCN(CC1)c2cccc(n2)F 27a_100000752442_100009815982 [0,2,0,0,0,0|2,0,0]=4 1636 B15R2.28 C=C1CCN(CC1)c2nccc(n2)C 27a_100000752442_100000750684 [0,2,0,0,0,0|1,0,0]=3 1637 B15R2.28 C=C1CCN(CC1)c2nccc(n2)N 27a_100000752442_100000757536 [0,2,0,0,0,0|1,0,0]=3 1638 B15R2.28 C=C1CCN(CC1)c2nccc(n2)O 27a_100000752442_100011649813 [0,2,0,0,0,0|1,0,0]=3 1639 B15R2.28 C=C1CCN(CC1)c2ncnc(n2)N 27a_100000752442_100000123831 [0,2,0,0,0,0|2,0,0]=4 1640 B15R2.28 CC1=CCCN(C1)c2ncc(cn2)Br 27a_100000725631_100000690281 [0,2,0,0,0,0|1,0,1]=4 1641 B15R2.28 CC1=CCCN(C1)c2ncc(cn2)C 27a_100000725631_100000061069 [0,2,0,0,0,0|1,0,1]=4 1642 B15R2.28 CC1=CCCN(C1)c2ncc(cn2)Cl 27a_100000725631_100011356929 [0,2,0,0,0,0|1,0,1]=4 1643 B15R2.28 CC1=CCCN(C1)c2ncc(cn2)F 27a_100000725631_100000685220 [0,2,0,0,0,0|1,0,1]=4 1644 B15R2.28 CC1=CCN(CC1)c2nccc(n2)C 27a_100000693516_100000750684 [0,2,0,0,0,0|1,0,1]=4 1645 B15R2.28 CC1=CCN(CC1)c2nccc(n2)N 27a_100000693516_100000757536 [0,2,0,0,0,0|1,0,1]=4 1646 B15R2.28 CC1=CCN(CC1)c2nccc(n2)O 27a_100000693516_100011649813 [0,2,0,0,0,0|1,0,1]=4 1647 B15R2.28 CC1CCN(CC1)c2cc(ccn2)F 27a_100000188429_100000764206 [0,2,0,0,0,0|2,0,0]=4 1648 B15R2.28 CC1CCN(CC1)c2cccc(n2)F 27a_100000188429_100009815982 [0,2,0,0,0,0|2,0,0]=4 1649 B15R2.28 CC1CCN(CC1)c2nccc(n2)N 27a_100000188429_100000757536 [0,2,0,0,0,0|1,0,0]=3 1650 B15R2.28 CC1CCN(CC1)c2nccc(n2)O 27a_100000188429_100011649813 [0,2,0,0,0,0|1,0,0]=3 1651 B15R2.28 CC1CCN(CC1)c2ncnc(n2)N 27a_100000188429_100000123831 [0,2,0,0,0,0|2,0,0]=4 1652 B15R2.28 CC1CN(CCO1)c2ccc(cn2)Br 27a_100000729577_100000686858 [0,2,0,0,0,0|2,0,0]=4 1653 B15R2.28 CC1CN(CCO1)c2ncc(cn2)Br 27a_100000729577_100000690281 [0,2,0,0,0,0|1,0,0]=3 1654 B15R2.28 CC1CN(CCO1)c2ncc(cn2)Cl 27a_100000729577_100011356929 [0,2,0,0,0,0|1,0,0]=3 1655 B15R2.28 CC1CN(CCO1)c2ncc(cn2)F 27a_100000729577_100000685220 [0,2,0,0,0,0|1,0,0]=3 1656 B15R2.28 CN1CCN(CC1)c2c[n+](ccn2)[O-] 27a_100000188432_100009880115 [0,2,0,0,0,0|2,0,0]=4 1657 B15R2.28 CN1CCN(CC1)c2cc(ccn2)Br 2230a_100010071329_200000210301 [0,2,0,0,0,0|1,0,0]=3 1658 B15R2.28 CN1CCN(CC1)c2cc(ccn2)Br 269982a_100010071329_200000210301 [0,2,0,0,0,0|1,0,0]=3 1659 B15R2.28 CN1CCN(CC1)c2cc(ccn2)Cl 2230a_100025705765_200000210301 [0,2,0,0,0,0|1,0,0]=3 1660 B15R2.28 CN1CCN(CC1)c2cc(ccn2)Cl 269982a_100025705765_200000210301 [0,2,0,0,0,0|1,0,0]=3 1661 B15R2.28 CN1CCN(CC1)c2cc(ccn2)F 27a_100000188432_100000764206 [0,2,0,0,0,0|1,0,0]=3 1662 B15R2.28 CN1CCN(CC1)c2cc(ncn2)Cl 2230a_100000757499_200000210301 [0,2,0,0,0,0|2,0,0]=4 1663 B15R2.28 CN1CCN(CC1)c2cc(ncn2)Cl 269982a_100000757499_200000210301 [0,2,0,0,0,0|2,0,0]=4 1664 B15R2.28 CN1CCN(CC1)c2cc(ncn2)F 27a_100000188432_200009880791 [0,2,0,0,0,0|2,0,0]=4 1665 B15R2.28 CN1CCN(CC1)c2cc(ncn2)N 27a_100000188432_100000701291 [0,2,0,0,0,0|2,0,0]=4 1666 B15R2.28 CN1CCN(CC1)c2cc(ncn2)O 271570a_203496583355_100011209858 [0,2,0,0,0,0|2,0,0]=4 1667 B15R2.28 CN1CCN(CC1)c2cc(ncn2)O 27a_100000188432_100000765262 [0,2,0,0,0,0|2,0,0]=4 1668 B15R2.28 CN1CCN(CC1)c2cc[nH]c(=O)n2 27a_100000188432_200000134032 [0,2,0,0,0,0|2,0,0]=4 1669 B15R2.28 CN1CCN(CC1)c2cccc(c2)Br 2230a_100000729370_200000210301 [0,2,0,0,0,0|2,0,0]=4 1670 B15R2.28 CN1CCN(CC1)c2cccc(c2)Br 269982a_100000729370_200000210301 [0,2,0,0,0,0|2,0,0]=4 1671 B15R2.28 CN1CCN(CC1)c2cccc(c2)Br 34a_100000729370_200000210301 [0,2,0,0,0,0|2,0,0]=4 1672 B15R2.28 CN1CCN(CC1)c2cccc(c2)O 2230a_100000217334_200000210301 [0,2,0,0,0,0|2,0,0]=4 1673 B15R2.28 CN1CCN(CC1)c2cccc(c2)O 269982a_100000217334_200000210301 [0,2,0,0,0,0|2,0,0]=4 1674 B15R2.28 CN1CCN(CC1)c2cccc(n2)Br 2230a_100015183193_200000210301 [0,2,0,0,0,0|1,0,0]=3 1675 B15R2.28 CN1CCN(CC1)c2cccc(n2)Br 269982a_100015183193_200000210301 [0,2,0,0,0,0|1,0,0]=3 1676 B15R2.28 CN1CCN(CC1)c2cccc(n2)Cl 2230a_100000741847_200000210301 [0,2,0,0,0,0|1,0,0]=3 1677 B15R2.28 CN1CCN(CC1)c2cccc(n2)Cl 269982a_100000741847_200000210301 [0,2,0,0,0,0|1,0,0]=3 1678 B15R2.28 CN1CCN(CC1)c2cccc(n2)F 27a_100000188432_100009815982 [0,2,0,0,0,0|1,0,0]=3 1679 B15R2.28 CN1CCN(CC1)c2cccc(n2)O 271570a_203496583355_100011209857 [0,2,0,0,0,0|1,0,0]=3 1680 B15R2.28 CN1CCN(CC1)c2ccnc(n2)N 27a_100000188432_100000055538 [0,2,0,0,0,0|2,0,0]=4 1681 B15R2.28 CN1CCN(CC1)c2cncc(n2)Cl 2230a_200015191129_200000210301 [0,2,0,0,0,0|2,0,0]=4 1682 B15R2.28 CN1CCN(CC1)c2cncc(n2)Cl 269982a_200015191129_200000210301 [0,2,0,0,0,0|2,0,0]=4 1683 B15R2.28 CN1CCN(CC1)c2cncc(n2)Cl 27a_100000188432_100010892449 [0,2,0,0,0,0|2,0,0]=4 1684 B15R2.28 CN1CCN(CC1)c2cncc(n2)F 27a_100000188432_200009863489 [0,2,0,0,0,0|2,0,0]=4 1685 B15R2.28 CN1CCN(CC1)c2cncc(n2)O 271570a_203496583355_100011209859 [0,2,0,0,0,0|2,0,0]=4 1686 B15R2.28 CN1CCN(CC1)c2nccc(n2)Cl 2230a_200020587174_200000210301 [0,2,0,0,0,0|0,0,0]=2 1687 B15R2.28 CN1CCN(CC1)c2nccc(n2)Cl 269982a_200020587174_200000210301 [0,2,0,0,0,0|0,0,0]=2 1688 B15R2.28 CN1CCN(CC1)c2nccc(n2)N 27a_100000188432_100000757536 [0,2,0,0,0,0|0,0,0]=2 1689 B15R2.28 CN1CCN(CC1)c2nccc(n2)O 27a_100000188432_100011649813 [0,2,0,0,0,0|0,0,0]=2 1690 B15R2.28 CN1CCN(CC1)c2ncnc(n2)N 27a_100000188432_100000123831 [0,2,0,0,0,0|1,0,0]=3 1691 B15R2.28 C[C@H]1CCCN(C1)c2ccc(cn2)Br 27a_100000717927_100000686858 [0,2,0,0,0,0|2,0,0]=4 1692 B15R2.28 C[C@H]1CCCN(C1)c2ncc(cn2)Br 27a_100000717927_100000690281 [0,2,0,0,0,0|1,0,0]=3 1693 B15R2.28 C[C@H]1CCCN(C1)c2ncc(cn2)Cl 27a_100000717927_100011356929 [0,2,0,0,0,0|1,0,0]=3 1694 B15R2.28 C[C@H]1CCCN(C1)c2ncc(cn2)F 27a_100000717927_100000685220 [0,2,0,0,0,0|1,0,0]=3 1695 B15R2.28 Cc1cc(ncn1)N2CCN(CC2)C 27a_100000188432_100000744208 [0,2,0,0,0,0|2,0,0]=4 1696 B15R2.28 Cc1cccc(c1)N2CCN(CC2)C 2230a_100000230922_200000210301 [0,2,0,0,0,0|2,0,0]=4 1697 B15R2.28 Cc1cccc(c1)N2CCN(CC2)C 269982a_100000230922_200000210301 [0,2,0,0,0,0|2,0,0]=4 1698 B15R2.28 Cc1cccc(c1)N2CCN(CC2)C 34a_100000230922_200000210301 [0,2,0,0,0,0|2,0,0]=4 1699 B15R2.28 Cc1cccc(c1)N2CCN(CC2)[13CH3] 2230a_100000230922_200025704644 [0,2,0,0,0,0|2,0,0]=4 1700 B15R2.28 Cc1cccc(c1)N2CCN(CC2)[13CH3] 269982a_100000230922_200025704644 [0,2,0,0,0,0|2,0,0]=4 1701 B15R2.28 Cc1cccc(c1)N2CCN(CC2)[13CH3] 34a_100000230922_200025704644 [0,2,0,0,0,0|2,0,0]=4 1702 B15R2.28 Cc1cccc(n1)N2CCN(CC2)C 2230a_100000689670_200000210301 [0,2,0,0,0,0|1,0,0]=3 1703 B15R2.28 Cc1cccc(n1)N2CCN(CC2)C 269982a_100000689670_200000210301 [0,2,0,0,0,0|1,0,0]=3 1704 B15R2.28 Cc1cccc(n1)N2CCN(CC2)[13CH3] 2230a_100000689670_200025704644 [0,2,0,0,0,0|1,0,0]=3 1705 B15R2.28 Cc1cccc(n1)N2CCN(CC2)[13CH3] 269982a_100000689670_200025704644 [0,2,0,0,0,0|1,0,0]=3 1706 B15R2.28 Cc1ccnc(c1)N2CCN(CC2)C 2230a_100000689466_200000210301 [0,2,0,0,0,0|1,0,0]=3 1707 B15R2.28 Cc1ccnc(c1)N2CCN(CC2)C 269982a_100000689466_200000210301 [0,2,0,0,0,0|1,0,0]=3 1708 B15R2.28 Cc1ccnc(c1)N2CCN(CC2)[13CH3] 2230a_100000689466_200025704644 [0,2,0,0,0,0|1,0,0]=3 1709 B15R2.28 Cc1ccnc(c1)N2CCN(CC2)[13CH3] 269982a_100000689466_200025704644 [0,2,0,0,0,0|1,0,0]=3 1710 B15R2.28 Cc1ccnc(n1)N2CCC(CC2)C 27a_100000188429_100000750684 [0,2,0,0,0,0|1,0,0]=3 1711 B15R2.28 Cc1ccnc(n1)N2CCC(CC2)F 27a_100015193889_100000750684 [0,2,0,0,0,0|1,0,0]=3 1712 B15R2.28 Cc1ccnc(n1)N2CCC(CC2)O 27a_100025773856_100000750684 [0,2,0,0,0,0|1,0,0]=3 1713 B15R2.28 Cc1ccnc(n1)N2CCN(CC2)C 27a_100000188432_100000750684 [0,2,0,0,0,0|0,0,0]=2 1714 B15R2.28 Cc1ccnc(n1)N2CCS(=O)CC2 27a_100000752083_100000750684 [0,2,0,0,0,0|1,0,0]=3 1715 B15R2.28 Cc1cnc(nc1)N2CCCC(C2)F 27a_100000697950_100000061069 [0,2,0,0,0,0|1,0,0]=3 1716 B15R2.28 Cc1cnc(nc1)N2CCCC(C2)O 27a_100000211013_100000061069 [0,2,0,0,0,0|1,0,0]=3 1717 B15R2.28 Cc1cnc(nc1)N2CCC[C@@H](C2)C 27a_100000717927_100000061069 [0,2,0,0,0,0|1,0,0]=3 1718 B15R2.28 Cc1cnc(nc1)N2CCNC(=O)C2 27a_100000184651_100000061069 [0,2,0,0,0,0|0,0,1]=3 1719 B15R2.28 Cc1cnc(nc1)N2CCOC(C2)C 27a_100000729577_100000061069 [0,2,0,0,0,0|1,0,0]=3 1720 B15R2.28 Cc1cncc(n1)N2CCN(CC2)C 2230a_100000068631_200000210301 [0,2,0,0,0,0|2,0,0]=4 1721 B15R2.28 Cc1cncc(n1)N2CCN(CC2)C 269982a_100000068631_200000210301 [0,2,0,0,0,0|2,0,0]=4 1722 B15R2.28 Cc1cncc(n1)N2CCN(CC2)C 27a_100000188432_100000754123 [0,2,0,0,0,0|2,0,0]=4 1723 B15R2.28 Cc1cncc(n1)N2CCN(CC2)[13CH3] 2230a_100000068631_200025704644 [0,2,0,0,0,0|2,0,0]=4 1724 B15R2.28 Cc1cncc(n1)N2CCN(CC2)[13CH3] 269982a_100000068631_200025704644 [0,2,0,0,0,0|2,0,0]=4 1725 B15R2.28 Cc1cnnc(c1)N2CCN(CC2)C 27a_100000188432_100000070100 [0,2,0,0,0,0|2,0,0]=4 1726 B15R2.28 Cc1nccc(n1)N2CCN(CC2)C 27a_100000188432_100000749937 [0,2,0,0,0,0|2,0,0]=4 1727 B15R2.28 FC1CCCN(C1)c2ccc(cn2)Br 27a_100000697950_100000686858 [0,2,0,0,0,0|2,0,0]=4 1728 B15R2.28 FC1CCCN(C1)c2ncc(cn2)Br 27a_100000697950_100000690281 [0,2,0,0,0,0|1,0,0]=3 1729 B15R2.28 FC1CCCN(C1)c2ncc(cn2)Cl 27a_100000697950_100011356929 [0,2,0,0,0,0|1,0,0]=3 1730 B15R2.28 Fc1cccc(n1)N2CCC(CC2)F 27a_100015193889_100009815982 [0,2,0,0,0,0|2,0,0]=4 1731 B15R2.28 Fc1ccnc(c1)N2CCC(CC2)F 27a_100015193889_100000764206 [0,2,0,0,0,0|2,0,0]=4 1732 B15R2.28 Fc1cnc(nc1)N2CCCC(C2)F 27a_100000697950_100000685220 [0,2,0,0,0,0|1,0,0]=3 1733 B15R2.28 Nc1ccnc(n1)N2CCC(CC2)F 27a_100015193889_100000757536 [0,2,0,0,0,0|1,0,0]=3 1734 B15R2.28 Nc1ccnc(n1)N2CCC(CC2)O 27a_100025773856_100000757536 [0,2,0,0,0,0|1,0,0]=3 1735 B15R2.28 Nc1ccnc(n1)N2CCS(=O)CC2 27a_100000752083_100000757536 [0,2,0,0,0,0|1,0,0]=3 1736 B15R2.28 Nc1ncnc(n1)N2CCC(CC2)F 27a_100015193889_100000123831 [0,2,0,0,0,0|2,0,0]=4 1737 B15R2.28 Nc1ncnc(n1)N2CCC(CC2)O 27a_100025773856_100000123831 [0,2,0,0,0,0|2,0,0]=4 1738 B15R2.28 Nc1ncnc(n1)N2CCS(=O)CC2 27a_100000752083_100000123831 [0,2,0,0,0,0|2,0,0]=4 1739 B15R2.28 O=C1CN(CCN1)c2ccc(cn2)Br 27a_100000184651_100000686858 [0,2,0,0,0,0|1,0,1]=4 1740 B15R2.28 O=C1CN(CCN1)c2ncc(cn2)Br 27a_100000184651_100000690281 [0,2,0,0,0,0|0,0,1]=3 1741 B15R2.28 O=C1CN(CCN1)c2ncc(cn2)Cl 27a_100000184651_100011356929 [0,2,0,0,0,0|0,0,1]=3 1742 B15R2.28 O=C1CN(CCN1)c2ncc(cn2)F 27a_100000184651_100000685220 [0,2,0,0,0,0|0,0,1]=3 1743 B15R2.28 O=S1CCN(CC1)c2cc(ccn2)F 27a_100000752083_100000764206 [0,2,0,0,0,0|2,0,0]=4 1744 B15R2.28 O=S1CCN(CC1)c2cccc(n2)F 27a_100000752083_100009815982 [0,2,0,0,0,0|2,0,0]=4 1745 B15R2.28 O=S1CCN(CC1)c2nccc(n2)O 27a_100000752083_100011649813 [0,2,0,0,0,0|1,0,0]=3 1746 B15R2.28 OC1CCCN(C1)c2ccc(cn2)Br 27a_100000211013_100000686858 [0,2,0,0,0,0|2,0,0]=4 1747 B15R2.28 OC1CCCN(C1)c2ncc(cn2)Br 27a_100000211013_100000690281 [0,2,0,0,0,0|1,0,0]=3 1748 B15R2.28 OC1CCCN(C1)c2ncc(cn2)Cl 27a_100000211013_100011356929 [0,2,0,0,0,0|1,0,0]=3 1749 B15R2.28 OC1CCCN(C1)c2ncc(cn2)F 27a_100000211013_100000685220 [0,2,0,0,0,0|1,0,0]=3 1750 B15R2.28 OC1CCN(CC1)c2cc(ccn2)F 27a_100025773856_100000764206 [0,2,0,0,0,0|2,0,0]=4 1751 B15R2.28 OC1CCN(CC1)c2cccc(n2)F 27a_100025773856_100009815982 [0,2,0,0,0,0|2,0,0]=4 1752 B15R2.28 Oc1cccc(n1)N2CCC(CC2)O 271570a_203496583355_200011880202 [0,2,0,0,0,0|2,0,0]=4 1753 B15R2.28 Oc1ccnc(n1)N2CCC(CC2)F 27a_100015193889_100011649813 [0,2,0,0,0,0|1,0,0]=3 1754 B15R2.28 Oc1ccnc(n1)N2CCC(CC2)O 27a_100025773856_100011649813 [0,2,0,0,0,0|1,0,0]=3 1755 B15R2.28 Oc1cnc(nc1)N2CCCC(C2)O 271570a_203496583355_200011938972 [0,2,0,0,0,0|1,0,0]=3 1756 B15R2.28 [13CH3]N1CCN(CC1)c2cc(ccn2)Br 2230a_100010071329_200025704644 [0,2,0,0,0,0|1,0,0]=3 1757 B15R2.28 [13CH3]N1CCN(CC1)c2cc(ccn2)Br 269982a_100010071329_200025704644 [0,2,0,0,0,0|1,0,0]=3 1758 B15R2.28 [13CH3]N1CCN(CC1)c2cc(ccn2)Cl 2230a_100025705765_200025704644 [0,2,0,0,0,0|1,0,0]=3 1759 B15R2.28 [13CH3]N1CCN(CC1)c2cc(ccn2)Cl 269982a_100025705765_200025704644 [0,2,0,0,0,0|1,0,0]=3 1760 B15R2.28 [13CH3]N1CCN(CC1)c2cc(ncn2)Cl 2230a_100000757499_200025704644 [0,2,0,0,0,0|2,0,0]=4 1761 B15R2.28 [13CH3]N1CCN(CC1)c2cc(ncn2)Cl 269982a_100000757499_200025704644 [0,2,0,0,0,0|2,0,0]=4 1762 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(c2)Br 2230a_100000729370_200025704644 [0,2,0,0,0,0|2,0,0]=4 1763 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(c2)Br 269982a_100000729370_200025704644 [0,2,0,0,0,0|2,0,0]=4 1764 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(c2)Br 34a_100000729370_200025704644 [0,2,0,0,0,0|2,0,0]=4 1765 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(c2)O 2230a_100000217334_200025704644 [0,2,0,0,0,0|2,0,0]=4 1766 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(c2)O 269982a_100000217334_200025704644 [0,2,0,0,0,0|2,0,0]=4 1767 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(n2)Br 2230a_100015183193_200025704644 [0,2,0,0,0,0|1,0,0]=3 1768 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(n2)Br 269982a_100015183193_200025704644 [0,2,0,0,0,0|1,0,0]=3 1769 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(n2)Cl 2230a_100000741847_200025704644 [0,2,0,0,0,0|1,0,0]=3 1770 B15R2.28 [13CH3]N1CCN(CC1)c2cccc(n2)Cl 269982a_100000741847_200025704644 [0,2,0,0,0,0|1,0,0]=3 1771 B15R2.28 [13CH3]N1CCN(CC1)c2cncc(n2)Cl 2230a_200015191129_200025704644 [0,2,0,0,0,0|2,0,0]=4 1772 B15R2.28 [13CH3]N1CCN(CC1)c2cncc(n2)Cl 269982a_200015191129_200025704644 [0,2,0,0,0,0|2,0,0]=4 1773 B15R2.28 [13CH3]N1CCN(CC1)c2nccc(n2)Cl 2230a_200020587174_200025704644 [0,2,0,0,0,0|0,0,0]=2 1774 B15R2.28 [13CH3]N1CCN(CC1)c2nccc(n2)Cl 269982a_200020587174_200025704644 [0,2,0,0,0,0|0,0,0]=2 1775 B15R2.30 CC1=CCCN(C1)c2nccc(n2)C 27a_100000725631_100000750684 [0,2,0,0,0,0|1,0,1]=4 1776 B15R2.30 CC1=CCCN(C1)c2nccc(n2)N 27a_100000725631_100000757536 [0,2,0,0,0,0|1,0,1]=4 1777 B15R2.30 CC1=CCCN(C1)c2nccc(n2)O 27a_100000725631_100011649813 [0,2,0,0,0,0|1,0,1]=4 1778 B15R2.30 CC1CN(CCO1)c2cc(ccn2)F 27a_100000729577_100000764206 [0,2,0,0,0,0|2,0,0]=4 1779 B15R2.30 CC1CN(CCO1)c2cccc(n2)F 27a_100000729577_100009815982 [0,2,0,0,0,0|2,0,0]=4 1780 B15R2.30 CC1CN(CCO1)c2nccc(n2)N 27a_100000729577_100000757536 [0,2,0,0,0,0|1,0,0]=3 1781 B15R2.30 CC1CN(CCO1)c2nccc(n2)O 27a_100000729577_100011649813 [0,2,0,0,0,0|1,0,0]=3 1782 B15R2.30 CC1CN(CCO1)c2ncnc(n2)N 27a_100000729577_100000123831 [0,2,0,0,0,0|2,0,0]=4 1783 B15R2.30 C[C@H]1CCCN(C1)c2cc(ccn2)F 27a_100000717927_100000764206 [0,2,0,0,0,0|2,0,0]=4 1784 B15R2.30 C[C@H]1CCCN(C1)c2cccc(n2)F 27a_100000717927_100009815982 [0,2,0,0,0,0|2,0,0]=4 1785 B15R2.30 C[C@H]1CCCN(C1)c2nccc(n2)N 27a_100000717927_100000757536 [0,2,0,0,0,0|1,0,0]=3 1786 B15R2.30 C[C@H]1CCCN(C1)c2nccc(n2)O 27a_100000717927_100011649813 [0,2,0,0,0,0|1,0,0]=3 1787 B15R2.30 C[C@H]1CCCN(C1)c2ncnc(n2)N 27a_100000717927_100000123831 [0,2,0,0,0,0|2,0,0]=4 1788 B15R2.30 Cc1ccnc(n1)N2CCCC(C2)F 27a_100000697950_100000750684 [0,2,0,0,0,0|1,0,0]=3 1789 B15R2.30 Cc1ccnc(n1)N2CCCC(C2)O 27a_100000211013_100000750684 [0,2,0,0,0,0|1,0,0]=3 1790 B15R2.30 Cc1ccnc(n1)N2CCC[C@@H](C2)C 27a_100000717927_100000750684 [0,2,0,0,0,0|1,0,0]=3 1791 B15R2.30 Cc1ccnc(n1)N2CCNC(=O)C2 27a_100000184651_100000750684 [0,2,0,0,0,0|0,0,1]=3 1792 B15R2.30 Cc1ccnc(n1)N2CCOC(C2)C 27a_100000729577_100000750684 [0,2,0,0,0,0|1,0,0]=3 1793 B15R2.30 Fc1cccc(n1)N2CCCC(C2)F 27a_100000697950_100009815982 [0,2,0,0,0,0|2,0,0]=4 1794 B15R2.30 Fc1ccnc(c1)N2CCCC(C2)F 27a_100000697950_100000764206 [0,2,0,0,0,0|2,0,0]=4 1795 B15R2.30 Nc1ccnc(n1)N2CCCC(C2)F 27a_100000697950_100000757536 [0,2,0,0,0,0|1,0,0]=3 1796 B15R2.30 Nc1ccnc(n1)N2CCCC(C2)O 27a_100000211013_100000757536 [0,2,0,0,0,0|1,0,0]=3 1797 B15R2.30 Nc1ccnc(n1)N2CCNC(=O)C2 27a_100000184651_100000757536 [0,2,0,0,0,0|0,0,1]=3 1798 B15R2.30 Nc1ncnc(n1)N2CCCC(C2)F 27a_100000697950_100000123831 [0,2,0,0,0,0|2,0,0]=4 1799 B15R2.30 Nc1ncnc(n1)N2CCCC(C2)O 27a_100000211013_100000123831 [0,2,0,0,0,0|2,0,0]=4 1800 B15R2.30 Nc1ncnc(n1)N2CCNC(=O)C2 27a_100000184651_100000123831 [0,2,0,0,0,0|1,0,1]=4 1801 B15R2.30 O=C1CN(CCN1)c2cc(ccn2)F 27a_100000184651_100000764206 [0,2,0,0,0,0|1,0,1]=4 1802 B15R2.30 O=C1CN(CCN1)c2cccc(n2)F 27a_100000184651_100009815982 [0,2,0,0,0,0|1,0,1]=4 1803 B15R2.30 O=C1CN(CCN1)c2nccc(n2)O 27a_100000184651_100011649813 [0,2,0,0,0,0|0,0,1]=3 1804 B15R2.30 OC1CCCN(C1)c2cc(ccn2)F 27a_100000211013_100000764206 [0,2,0,0,0,0|2,0,0]=4 1805 B15R2.30 OC1CCCN(C1)c2cccc(n2)F 27a_100000211013_100009815982 [0,2,0,0,0,0|2,0,0]=4 1806 B15R2.30 Oc1ccnc(n1)N2CCCC(C2)F 27a_100000697950_100011649813 [0,2,0,0,0,0|1,0,0]=3 1807 B15R2.30 Oc1ccnc(n1)N2CCCC(C2)O 27a_100000211013_100011649813 [0,2,0,0,0,0|1,0,0]=3 1808 B15R2.32 CC1C(=O)NCCN1c2ncccn2 27a_100000750721_100000211032 [0,2,0,0,0,0|0,0,1]=3 1809 B15R2.32 Cc1c(ccnc1N2CCOCC2)F 27a_100015191051_100009846374 [0,2,0,0,0,0|2,0,0]=4 1810 B15R2.32 Cc1c(ccnc1N2CCSCC2)F 27a_100000737611_100009846374 [0,2,0,0,0,0|2,0,0]=4 1811 B15R2.33 C[C@@H]1CN([C@@H](CO1)C)c2ncccn2 27a_100016991869_100000211032 [0,2,0,0,0,0|1,0,0]=3 1812 B15R2.33 Fc1ccc(c(n1)N2CCOCC2)F 27a_100015191051_100010997973 [0,2,0,0,0,0|2,0,0]=4 1813 B15R2.33 Fc1ccc(c(n1)N2CCSCC2)F 27a_100000737611_100010997973 [0,2,0,0,0,0|2,0,0]=4 1814 B15R2.33 Nc1ccc(nc1N2CCOCC2)F 27a_100015191051_100009879877 [0,2,0,0,0,0|2,0,0]=4 1815 B15R2.33 Nc1ccc(nc1N2CCSCC2)F 27a_100000737611_100009879877 [0,2,0,0,0,0|2,0,0]=4 1816 B15R2.33 Nc1ncc(nc1N2CCNCC2)O 271570a_203496583355_200016992098 [0,2,0,0,0,0|2,0,0]=4 1817 B15R2.94 CC1CCN(CC1O)c2ncccn2 27a_100000696640_100000211032 [0,2,0,0,0,0|1,0,0]=3 1818 B15R2.94 CC1CN(CCC1O)c2ncccn2 27a_100011998114_100000211032 [0,2,0,0,0,0|1,0,0]=3 1819 B15R2.94 CC1CN(CCN1C)c2ccccc2 2230a_100015186963_200000210301 [0,2,0,0,0,0|2,0,0]=4 1820 B15R2.94 CC1CN(CCN1C)c2ccccc2 269982a_100015186963_200000210301 [0,2,0,0,0,0|2,0,0]=4 1821 B15R2.94 CC1CN(CCN1C)c2ccccc2 34a_100015186963_200000210301 [0,2,0,0,0,0|2,0,0]=4 1822 B15R2.94 CC1CN(CCN1[13CH3])c2ccccc2 2230a_100015186963_200025704644 [0,2,0,0,0,0|2,0,0]=4 1823 B15R2.94 CC1CN(CCN1[13CH3])c2ccccc2 269982a_100015186963_200025704644 [0,2,0,0,0,0|2,0,0]=4 1824 B15R2.94 CC1CN(CCN1[13CH3])c2ccccc2 34a_100015186963_200025704644 [0,2,0,0,0,0|2,0,0]=4 1825 B15R2.94 CN1CCN(CC1=O)c2ncccn2 27a_100000187256_100000211032 [0,2,0,0,0,0|0,0,1]=3 1826 B15R2.94 C[C@H]1CN(CCN1C)c2cccnn2 27a_100020603432_100016991348 [0,2,0,0,0,0|2,0,0]=4 1827 B15R2.94 C[C@H]1CN(CCN1C)c2ccncn2 27a_100020603432_100000703185 [0,2,0,0,0,0|2,0,0]=4 1828 B15R2.94 C[C@H]1CN(CCN1C)c2cnccn2 27a_100020603432_100000211759 [0,2,0,0,0,0|2,0,0]=4 1829 B15R2.94 C[C@H]1CN(CCN1C)c2ncccn2 27a_100020603432_100000211032 [0,2,0,0,0,0|0,0,0]=2 1830 B15R2.94 Cc1cc(ncc1O)N2CCNCC2 271570a_203496583355_112257584020 [0,2,0,0,0,0|1,0,0]=3 1831 B15R2.94 Cc1cc(ncc1O)N2CCOCC2 271570a_203496583355_200012349133 [0,2,0,0,0,0|2,0,0]=4 1832 B15R2.94 Cc1cnc(cc1F)N2CCOCC2 27a_100015191051_100009841206 [0,2,0,0,0,0|2,0,0]=4 1833 B15R2.94 Cc1cnc(cc1F)N2CCSCC2 27a_100000737611_100009841206 [0,2,0,0,0,0|2,0,0]=4 1834 B15R2.94 Cc1cnc(nc1N)C2=CCNCC2 271570a_100000731432_100011996698 [0,2,0,0,0,0|1,0,1]=4 1835 B15R2.94 Cc1cnc(nc1N)N2CC=CCC2 27a_100000698166_100011996698 [0,2,0,0,0,0|1,0,1]=4 1836 B15R2.94 Cc1cnc(nc1N)N2CCOCC2 27a_100015191051_100011996698 [0,2,0,0,0,0|1,0,0]=3 1837 B15R2.94 Cc1cnc(nc1N)N2CCSCC2 27a_100000737611_100011996698 [0,2,0,0,0,0|1,0,0]=3 1838 B15R2.94 Cc1nc(ccc1O)N2CCNCC2 271570a_203496583355_100020629703 [0,2,0,0,0,0|1,0,0]=3 1839 B15R2.94 Cc1nc(ncc1Cl)C2=CCNCC2 271570a_100000731432_100010174973 [0,2,0,0,0,0|1,0,1]=4 1840 B15R2.94 Cc1nc(ncc1Cl)N2CC=CCC2 27a_100000698166_100010174973 [0,2,0,0,0,0|1,0,1]=4 1841 B15R2.94 Cc1nc(ncc1Cl)N2CCOCC2 27a_100015191051_100010174973 [0,2,0,0,0,0|1,0,0]=3 1842 B15R2.94 Cc1nc(ncc1Cl)N2CCSCC2 27a_100000737611_100010174973 [0,2,0,0,0,0|1,0,0]=3 1843 B15R2.94 Cc1nc(ncc1F)C2=CCNCC2 271570a_100000731432_100015641512 [0,2,0,0,0,0|1,0,1]=4 1844 B15R2.94 Cc1nc(ncc1F)N2CC=CCC2 27a_100000698166_100015641512 [0,2,0,0,0,0|1,0,1]=4 1845 B15R2.94 Cc1nc(ncc1F)N2CCOCC2 27a_100015191051_100015641512 [0,2,0,0,0,0|1,0,0]=3 1846 B15R2.94 Cc1nc(ncc1F)N2CCSCC2 27a_100000737611_100015641512 [0,2,0,0,0,0|1,0,0]=3 1847 B15R2.94 Cc1nc(ncc1N)C2=CCNCC2 271570a_100000731432_100000123670 [0,2,0,0,0,0|1,0,1]=4 1848 B15R2.94 Cc1nc(ncc1N)N2CC=CCC2 27a_100000698166_100000123670 [0,2,0,0,0,0|1,0,1]=4 1849 B15R2.94 Cc1nc(ncc1N)N2CCOCC2 27a_100015191051_100000123670 [0,2,0,0,0,0|1,0,0]=3 1850 B15R2.94 Cc1nc(ncc1N)N2CCSCC2 27a_100000737611_100000123670 [0,2,0,0,0,0|1,0,0]=3 1851 B15R2.94 Fc1nc(ccc1Br)N2CCOCC2 27a_100015191051_100010134343 [0,2,0,0,0,0|2,0,0]=4 1852 B15R2.94 Fc1nc(ccc1Br)N2CCSCC2 27a_100000737611_100010134343 [0,2,0,0,0,0|2,0,0]=4 1853 B15R2.94 Nc1cnc(nc1N)C2=CCNCC2 271570a_100000731432_100011933915 [0,2,0,0,0,0|1,0,1]=4 1854 B15R2.94 Nc1nc(ncc1F)C2=CCNCC2 271570a_100000731432_100000185498 [0,2,0,0,0,0|1,0,1]=4 1855 B15R2.94 Nc1nc(ncc1F)N2CC=CCC2 27a_100000698166_100000185498 [0,2,0,0,0,0|1,0,1]=4 1856 B15R2.94 Nc1nc(ncc1F)N2CCOCC2 27a_100015191051_100000185498 [0,2,0,0,0,0|1,0,0]=3 1857 B15R2.94 Nc1nc(ncc1F)N2CCSCC2 27a_100000737611_100000185498 [0,2,0,0,0,0|1,0,0]=3 1858 B15R2.94 O[C@@H]1CCN(C[C@@H]1F)c2ncccn2 27a_200016994291_100000211032 [0,2,0,0,0,0|1,0,0]=3 1859 B15R2.94 O[C@@H]1CCN(C[C@@H]1O)c2ncccn2 27a_100000690696_100000211032 [0,2,0,0,0,0|1,0,0]=3 1860 B15R2.94 Oc1nc(ncc1F)C2=CCNCC2 271570a_100000731432_100011995740 [0,2,0,0,0,0|1,0,1]=4 1861 B15R2.94 Oc1nc(ncc1F)N2CC=CCC2 27a_100000698166_100011995740 [0,2,0,0,0,0|1,0,1]=4 1862 B15R2.94 Oc1nc(ncc1F)N2CCOCC2 27a_100015191051_100011995740 [0,2,0,0,0,0|1,0,0]=3 1863 B15R2.94 Oc1nc(ncc1F)N2CCSCC2 27a_100000737611_100011995740 [0,2,0,0,0,0|1,0,0]=3 1864 B15R2.332 CC1CCCCN1c2cc(ccn2)F 27a_100000211376_100000764206 [0,2,0,0,0,0|2,0,0]=4 1865 B15R2.332 CC1CCCCN1c2cccc(n2)F 27a_100000211376_100009815982 [0,2,0,0,0,0|2,0,0]=4 1866 B15R2.332 CC1CCCCN1c2nccc(n2)N 27a_100000211376_100000757536 [0,2,0,0,0,0|1,0,0]=3 1867 B15R2.332 CC1CCCCN1c2nccc(n2)O 27a_100000211376_100011649813 [0,2,0,0,0,0|1,0,0]=3 1868 B15R2.332 CC1CCCCN1c2ncnc(n2)N 27a_100000211376_100000123831 [0,2,0,0,0,0|2,0,0]=4 1869 B15R2.332 CC1CN(CCO1)c2ncccc2Br 27a_100000729577_100000696092 [0,2,0,0,0,0|2,0,0]=4 1870 B15R2.332 C[C@H]1CCCN(C1)c2ncccc2Br 27a_100000717927_100000696092 [0,2,0,0,0,0|2,0,0]=4 1871 B15R2.332 C[C@H]1COCCN1c2cc(ccn2)F 27a_100009815349_100000764206 [0,2,0,0,0,0|2,0,0]=4 1872 B15R2.332 C[C@H]1COCCN1c2cccc(n2)F 27a_100009815349_100009815982 [0,2,0,0,0,0|2,0,0]=4 1873 B15R2.332 C[C@H]1COCCN1c2nccc(n2)N 27a_100009815349_100000757536 [0,2,0,0,0,0|1,0,0]=3 1874 B15R2.332 C[C@H]1COCCN1c2nccc(n2)O 27a_100009815349_100011649813 [0,2,0,0,0,0|1,0,0]=3 1875 B15R2.332 C[C@H]1COCCN1c2ncnc(n2)N 27a_100009815349_100000123831 [0,2,0,0,0,0|2,0,0]=4 1876 B15R2.332 Cc1ccnc(n1)N2CCCCC2C 27a_100000211376_100000750684 [0,2,0,0,0,0|1,0,0]=3 1877 B15R2.332 Cc1ccnc(n1)N2CCOC[C@@H]2C 27a_100009815349_100000750684 [0,2,0,0,0,0|1,0,0]=3 1878 B15R2.332 FC1CCCN(C1)c2ncccc2Br 27a_100000697950_100000696092 [0,2,0,0,0,0|2,0,0]=4 1879 B15R2.332 O=C1CN(CCN1)c2ncccc2Br 27a_100000184651_100000696092 [0,2,0,0,0,0|1,0,1]=4 1880 B15R2.332 OC1CCCN(C1)c2ncccc2Br 27a_100000211013_100000696092 [0,2,0,0,0,0|2,0,0]=4 1881 B15R2.586 CC1(CCCN(C1)c2ncccn2)C 27a_100000716857_100000211032 [0,2,0,0,0,0|1,0,0]=3 1882 B15R2.586 CC1(CCCN(C1)c2ncccn2)O 27a_100000695535_100000211032 [0,2,0,0,0,0|1,0,0]=3 1883 B15R2.586 CC1(CN(CCO1)c2ncccn2)C 27a_100000738910_100000211032 [0,2,0,0,0,0|1,0,0]=3 1884 B15R2.586 FC1(CCCN(C1)c2ncccn2)F 27a_100000732682_100000211032 [0,2,0,0,0,0|1,0,0]=3 1885 B15R2.21 C#CC1CCCCN1c2ncccn2 27a_200020621307_100000211032 [0,2,0,0,0,0|1,0,0]=3 1886 B15R2.21 C=Cc1ccccc1N2CCNCC2 271570a_100011290941_102495324788 [0,2,0,0,0,0|2,0,0]=4 1887 B15R2.21 C=Cc1cccnc1N2CCCCC2 271570a_100011290941_200103154647 [0,2,0,0,0,0|2,0,0]=4 1888 B15R2.21 C=Cc1cccnc1N2CCNCC2 271570a_100011290941_200000047011 [0,2,0,0,0,0|1,0,0]=3 1889 B15R2.21 C=Cc1cccnc1N2CCOCC2 271570a_100011290941_200011465045 [0,2,0,0,0,0|2,0,0]=4 1890 B15R2.21 C=Cc1nccnc1N2CCNCC2 271570a_100011290941_200020639423 [0,2,0,0,0,0|2,0,0]=4 1891 B15R2.21 CCC1CCCCN1c2ncccn2 27a_100000210034_100000211032 [0,2,0,0,0,0|1,0,0]=3 1892 B15R2.21 CC[C@H]1COCCN1c2ncccn2 27a_100016988097_100000211032 [0,2,0,0,0,0|1,0,0]=3 1893 B15R2.21 COc1ccccc1N2CCNCC2 34a_100000688944_200000210301 [0,2,0,0,0,0|2,0,0]=4 1894 B15R2.21 CSc1ccccc1N2CCNCC2 62a_102495324788_200000210301 [0,2,0,0,0,0|2,0,0]=4 1895 B15R2.21 CSc1ccccc1N2CCNCC2 62a_200000210301_102495324788 [0,2,0,0,0,0|2,0,0]=4 1896 B15R2.21 CSc1cccnc1N2CCCCC2 62a_200000210301_200103154647 [0,2,0,0,0,0|2,0,0]=4 1897 B15R2.21 CSc1cccnc1N2CCCCC2 62a_200103154647_200000210301 [0,2,0,0,0,0|2,0,0]=4 1898 B15R2.21 CSc1cccnc1N2CCNCC2 62a_200000047011_200000210301 [0,2,0,0,0,0|1,0,0]=3 1899 B15R2.21 CSc1cccnc1N2CCNCC2 62a_200000210301_200000047011 [0,2,0,0,0,0|1,0,0]=3 1900 B15R2.21 CSc1cccnc1N2CCOCC2 62a_200000210301_200011465045 [0,2,0,0,0,0|2,0,0]=4 1901 B15R2.21 CSc1cccnc1N2CCOCC2 62a_200011465045_200000210301 [0,2,0,0,0,0|2,0,0]=4 1902 B15R2.21 CSc1nccnc1N2CCNCC2 62a_200000210301_200020639423 [0,2,0,0,0,0|2,0,0]=4 1903 B15R2.21 N#CC1CCCCN1c2ncccn2 27a_100016989756_100000211032 [0,2,0,0,0,0|1,0,0]=3 1904 B15R2.21 N#Cc1cccnc1N2CCOCC2 27a_100015191051_100000211984 [0,2,0,0,0,0|2,0,0]=4 1905 B15R2.21 N#Cc1cccnc1N2CCSCC2 27a_100000737611_100000211984 [0,2,0,0,0,0|2,0,0]=4 1906 B15R2.21 OCC1CCCCN1c2ncccn2 27a_100000210821_100000211032 [0,2,0,0,0,0|1,0,0]=3 1907 B15R2.21 OC[C@@H]1COCCN1c2ncccn2 27a_100000717676_100000211032 [0,2,0,0,0,0|1,0,0]=3 1908 B15R2.21 [13CH3]Oc1ccccc1N2CCNCC2 34a_100000688944_200025704644 [0,2,0,0,0,0|2,0,0]=4 1909 B15R2.21 [13CH3]Sc1ccccc1N2CCNCC2 62a_102495324788_200025704644 [0,2,0,0,0,0|2,0,0]=4 1910 B15R2.21 [13CH3]Sc1ccccc1N2CCNCC2 62a_200025704644_102495324788 [0,2,0,0,0,0|2,0,0]=4 1911 B15R2.21 [13CH3]Sc1cccnc1N2CCCCC2 62a_200025704644_200103154647 [0,2,0,0,0,0|2,0,0]=4 1912 B15R2.21 [13CH3]Sc1cccnc1N2CCCCC2 62a_200103154647_200025704644 [0,2,0,0,0,0|2,0,0]=4 1913 B15R2.21 [13CH3]Sc1cccnc1N2CCNCC2 62a_200000047011_200025704644 [0,2,0,0,0,0|1,0,0]=3 1914 B15R2.21 [13CH3]Sc1cccnc1N2CCNCC2 62a_200025704644_200000047011 [0,2,0,0,0,0|1,0,0]=3 1915 B15R2.21 [13CH3]Sc1cccnc1N2CCOCC2 62a_200011465045_200025704644 [0,2,0,0,0,0|2,0,0]=4 1916 B15R2.21 [13CH3]Sc1cccnc1N2CCOCC2 62a_200025704644_200011465045 [0,2,0,0,0,0|2,0,0]=4 1917 B15R2.21 [13CH3]Sc1nccnc1N2CCNCC2 62a_200025704644_200020639423 [0,2,0,0,0,0|2,0,0]=4 1918 B15R2.308 C=C1CCN(CC1)c2ncccc2Br 27a_100000752442_100000696092 [0,2,0,0,0,0|2,0,0]=4 1919 B15R2.308 CC1CCCCN1c2ccc(cn2)Br 27a_100000211376_100000686858 [0,2,0,0,0,0|2,0,0]=4 1920 B15R2.308 CC1CCCCN1c2ncc(cn2)Br 27a_100000211376_100000690281 [0,2,0,0,0,0|1,0,0]=3 1921 B15R2.308 CC1CCCCN1c2ncc(cn2)Cl 27a_100000211376_100011356929 [0,2,0,0,0,0|1,0,0]=3 1922 B15R2.308 CC1CCCCN1c2ncc(cn2)F 27a_100000211376_100000685220 [0,2,0,0,0,0|1,0,0]=3 1923 B15R2.308 CC1CCN(CC1)c2ncccc2Br 27a_100000188429_100000696092 [0,2,0,0,0,0|2,0,0]=4 1924 B15R2.308 CN1CCN(CC1)c2ccccc2Br 2230a_102495324788_200000210301 [0,2,0,0,0,0|2,0,0]=4 1925 B15R2.308 CN1CCN(CC1)c2ccccc2Br 269982a_102495324788_200000210301 [0,2,0,0,0,0|2,0,0]=4 1926 B15R2.308 CN1CCN(CC1)c2ccccc2Cl 2230a_100000727487_200000210301 [0,2,0,0,0,0|2,0,0]=4 1927 B15R2.308 CN1CCN(CC1)c2ccccc2Cl 269982a_100000727487_200000210301 [0,2,0,0,0,0|2,0,0]=4 1928 B15R2.308 CN1CCN(CC1)c2ccccc2Cl 34a_100000727487_200000210301 [0,2,0,0,0,0|2,0,0]=4 1929 B15R2.308 CN1CCN(CC1)c2ccccc2F 2230a_100000210442_200000210301 [0,2,0,0,0,0|2,0,0]=4 1930 B15R2.308 CN1CCN(CC1)c2ccccc2F 269982a_100000210442_200000210301 [0,2,0,0,0,0|2,0,0]=4 1931 B15R2.308 CN1CCN(CC1)c2ccccc2F 34a_100000210442_200000210301 [0,2,0,0,0,0|2,0,0]=4 1932 B15R2.308 CN1CCN(CC1)c2ccccc2O 2230a_100000688944_200000210301 [0,2,0,0,0,0|2,0,0]=4 1933 B15R2.308 CN1CCN(CC1)c2ccccc2O 269982a_100000688944_200000210301 [0,2,0,0,0,0|2,0,0]=4 1934 B15R2.308 CN1CCN(CC1)c2ncccc2Br 27a_100000188432_100000696092 [0,2,0,0,0,0|1,0,0]=3 1935 B15R2.308 CN1CCN(CC1)c2ncccc2Cl 2230a_100000742284_200000210301 [0,2,0,0,0,0|1,0,0]=3 1936 B15R2.308 CN1CCN(CC1)c2ncccc2Cl 269982a_100000742284_200000210301 [0,2,0,0,0,0|1,0,0]=3 1937 B15R2.308 CN1CCN(CC1)c2ncccc2I 2230a_200000047011_200000210301 [0,2,0,0,0,0|1,0,0]=3 1938 B15R2.308 CN1CCN(CC1)c2ncccc2I 269982a_200000047011_200000210301 [0,2,0,0,0,0|1,0,0]=3 1939 B15R2.308 CN1CCN(CC1)c2nccnc2Cl 2230a_200020639423_200000210301 [0,2,0,0,0,0|2,0,0]=4 1940 B15R2.308 CN1CCN(CC1)c2nccnc2Cl 269982a_200020639423_200000210301 [0,2,0,0,0,0|2,0,0]=4 1941 B15R2.308 CN1CCN(CC1)c2nccnc2F 27a_100000188432_200010125657 [0,2,0,0,0,0|2,0,0]=4 1942 B15R2.308 CN1CCN(CC1)c2nccnc2O 2230a_100015187551_200000210301 [0,2,0,0,0,0|2,0,0]=4 1943 B15R2.308 CN1CCN(CC1)c2nccnc2O 269982a_100015187551_200000210301 [0,2,0,0,0,0|2,0,0]=4 1944 B15R2.308 CN1CCN(CC1)c2ncncc2F 27a_100000188432_100000069762 [0,2,0,0,0,0|2,0,0]=4 1945 B15R2.308 CN1CCN(CC1)c2ncncc2N 27a_100000188432_100000709731 [0,2,0,0,0,0|2,0,0]=4 1946 B15R2.308 C[C@H]1COCCN1c2ccc(cn2)Br 27a_100009815349_100000686858 [0,2,0,0,0,0|2,0,0]=4 1947 B15R2.308 C[C@H]1COCCN1c2ncc(cn2)Br 27a_100009815349_100000690281 [0,2,0,0,0,0|1,0,0]=3 1948 B15R2.308 C[C@H]1COCCN1c2ncc(cn2)Cl 27a_100009815349_100011356929 [0,2,0,0,0,0|1,0,0]=3 1949 B15R2.308 C[C@H]1COCCN1c2ncc(cn2)F 27a_100009815349_100000685220 [0,2,0,0,0,0|1,0,0]=3 1950 B15R2.308 Cc1ccccc1N2CCN(CC2)C 2230a_100000739941_200000210301 [0,2,0,0,0,0|2,0,0]=4 1951 B15R2.308 Cc1ccccc1N2CCN(CC2)C 269982a_100000739941_200000210301 [0,2,0,0,0,0|2,0,0]=4 1952 B15R2.308 Cc1ccccc1N2CCN(CC2)C 34a_100000739941_200000210301 [0,2,0,0,0,0|2,0,0]=4 1953 B15R2.308 Cc1ccccc1N2CCN(CC2)[13CH3] 2230a_100000739941_200025704644 [0,2,0,0,0,0|2,0,0]=4 1954 B15R2.308 Cc1ccccc1N2CCN(CC2)[13CH3] 269982a_100000739941_200025704644 [0,2,0,0,0,0|2,0,0]=4 1955 B15R2.308 Cc1ccccc1N2CCN(CC2)[13CH3] 34a_100000739941_200025704644 [0,2,0,0,0,0|2,0,0]=4 1956 B15R2.308 Cc1cccnc1N2CCN(CC2)C 2230a_200011630363_200000210301 [0,2,0,0,0,0|1,0,0]=3 1957 B15R2.308 Cc1cccnc1N2CCN(CC2)C 269982a_200011630363_200000210301 [0,2,0,0,0,0|1,0,0]=3 1958 B15R2.308 Cc1cccnc1N2CCN(CC2)[13CH3] 2230a_200011630363_200025704644 [0,2,0,0,0,0|1,0,0]=3 1959 B15R2.308 Cc1cccnc1N2CCN(CC2)[13CH3] 269982a_200011630363_200025704644 [0,2,0,0,0,0|1,0,0]=3 1960 B15R2.308 Cc1ccnnc1N2CCN(CC2)C 27a_100000188432_100000089043 [0,2,0,0,0,0|2,0,0]=4 1961 B15R2.308 Cc1cnc(nc1)N2CCCCC2C 27a_100000211376_100000061069 [0,2,0,0,0,0|1,0,0]=3 1962 B15R2.308 Cc1cnc(nc1)N2CCOC[C@@H]2C 27a_100009815349_100000061069 [0,2,0,0,0,0|1,0,0]=3 1963 B15R2.308 Cc1cncnc1N2CCN(CC2)C 27a_100000188432_100011998708 [0,2,0,0,0,0|2,0,0]=4 1964 B15R2.308 Cc1nccnc1N2CCN(CC2)C 27a_100000188432_100011999405 [0,2,0,0,0,0|2,0,0]=4 1965 B15R2.308 FC1CCN(CC1)c2ncccc2Br 27a_100015193889_100000696092 [0,2,0,0,0,0|2,0,0]=4 1966 B15R2.308 O=S1CCN(CC1)c2ncccc2Br 27a_100000752083_100000696092 [0,2,0,0,0,0|2,0,0]=4 1967 B15R2.308 OC1CCN(CC1)c2ncccc2Br 27a_100025773856_100000696092 [0,2,0,0,0,0|2,0,0]=4 1968 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2Br 2230a_102495324788_200025704644 [0,2,0,0,0,0|2,0,0]=4 1969 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2Br 269982a_102495324788_200025704644 [0,2,0,0,0,0|2,0,0]=4 1970 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2Cl 2230a_100000727487_200025704644 [0,2,0,0,0,0|2,0,0]=4 1971 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2Cl 269982a_100000727487_200025704644 [0,2,0,0,0,0|2,0,0]=4 1972 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2Cl 34a_100000727487_200025704644 [0,2,0,0,0,0|2,0,0]=4 1973 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2F 2230a_100000210442_200025704644 [0,2,0,0,0,0|2,0,0]=4 1974 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2F 269982a_100000210442_200025704644 [0,2,0,0,0,0|2,0,0]=4 1975 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2F 34a_100000210442_200025704644 [0,2,0,0,0,0|2,0,0]=4 1976 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2O 2230a_100000688944_200025704644 [0,2,0,0,0,0|2,0,0]=4 1977 B15R2.308 [13CH3]N1CCN(CC1)c2ccccc2O 269982a_100000688944_200025704644 [0,2,0,0,0,0|2,0,0]=4 1978 B15R2.308 [13CH3]N1CCN(CC1)c2ncccc2Cl 2230a_100000742284_200025704644 [0,2,0,0,0,0|1,0,0]=3 1979 B15R2.308 [13CH3]N1CCN(CC1)c2ncccc2Cl 269982a_100000742284_200025704644 [0,2,0,0,0,0|1,0,0]=3 1980 B15R2.308 [13CH3]N1CCN(CC1)c2ncccc2I 2230a_200000047011_200025704644 [0,2,0,0,0,0|1,0,0]=3 1981 B15R2.308 [13CH3]N1CCN(CC1)c2ncccc2I 269982a_200000047011_200025704644 [0,2,0,0,0,0|1,0,0]=3 1982 B15R2.308 [13CH3]N1CCN(CC1)c2nccnc2Cl 2230a_200020639423_200025704644 [0,2,0,0,0,0|2,0,0]=4 1983 B15R2.308 [13CH3]N1CCN(CC1)c2nccnc2Cl 269982a_200020639423_200025704644 [0,2,0,0,0,0|2,0,0]=4 1984 B15R2.308 [13CH3]N1CCN(CC1)c2nccnc2O 2230a_100015187551_200025704644 [0,2,0,0,0,0|2,0,0]=4 1985 B15R2.308 [13CH3]N1CCN(CC1)c2nccnc2O 269982a_100015187551_200025704644 [0,2,0,0,0,0|2,0,0]=4 1986 B15R2.389 C[C@H]1CN(CCN1c2cccnn2)C 27a_100012002466_100016991348 [0,2,0,0,0,0|2,0,0]=4 1987 B15R2.389 C[C@H]1CN(CCN1c2ccncn2)C 27a_100012002466_100000703185 [0,2,0,0,0,0|2,0,0]=4 1988 B15R2.389 C[C@H]1CN(CCN1c2cnccn2)C 27a_100012002466_100000211759 [0,2,0,0,0,0|2,0,0]=4 1989 B15R2.389 C[C@H]1CN(CCN1c2ncccn2)C 27a_100012002466_100000211032 [0,2,0,0,0,0|0,0,0]=2 1990 B15R2.389 Cc1cc(ccc1N2CCNCC2)O 271570a_203496583355_200011360475 [0,2,0,0,0,0|2,0,0]=4 1991 B15R2.389 Cc1cc(cnc1N2CCNCC2)O 271570a_203496583355_200012354832 [0,2,0,0,0,0|1,0,0]=3 1992 B15R2.389 Nc1cnc(c(c1)O)N2CCOCC2 271570a_203496583355_100000726669 [0,2,0,0,0,0|2,0,0]=4 1993 B15R2.541 CC1CCCC(N1c2ncccn2)C 27a_100000210447_100000211032 [0,2,0,0,0,0|1,0,0]=3 1994 B15R2.541 C[C@@H]1COC[C@@H](N1c2ncccn2)C 27a_100103153222_100000211032 [0,2,0,0,0,0|1,0,0]=3 1995 B15R2.555 CC1CCCCN1c2ncccc2Br 27a_100000211376_100000696092 [0,2,0,0,0,0|2,0,0]=4 1996 B15R2.555 C[C@H]1COCCN1c2ncccc2Br 27a_100009815349_100000696092 [0,2,0,0,0,0|2,0,0]=4 1997 B15R2.1 C#CC1CCN(CC1)c2ncccn2 27a_100016991398_100000211032 [0,2,0,0,0,0|1,0,0]=3 1998 B15R2.1 C=Cc1ccc(cc1)N2CCNCC2 271570a_100011290941_100011236372 [0,2,0,0,0,0|2,0,0]=4 1999 B15R2.1 C=Cc1ccc(nc1)N2CCCCC2 271570a_100011290941_200102616235 [0,2,0,0,0,0|2,0,0]=4 2000 B15R2.1 C=Cc1ccc(nc1)N2CCNCC2 271570a_100011290941_100000739387 [0,2,0,0,0,0|1,0,0]=3 2001 B15R2.1 C=Cc1ccc(nc1)N2CCOCC2 271570a_100011290941_100011465330 [0,2,0,0,0,0|2,0,0]=4 2002 B15R2.1 C=Cc1ccc(nn1)N2CCNCC2 271570a_100011290941_100000736700 [0,2,0,0,0,0|2,0,0]=4 2003 B15R2.1 C=Cc1cnc(nc1)N2CC=CCC2 27a_100000698166_200000143982 [0,2,0,0,0,0|1,0,1]=4 2004 B15R2.1 C=Cc1cnc(nc1)N2CCCCC2 271570a_100011290941_100011934054 [0,2,0,0,0,0|1,0,0]=3 2005 B15R2.1 C=Cc1cnc(nc1)N2CCNCC2 271570a_100011290941_100000739398 [0,2,0,0,0,0|0,0,0]=2 2006 B15R2.1 C=Cc1cnc(nc1)N2CCOCC2 271570a_100011290941_100011397833 [0,2,0,0,0,0|1,0,0]=3 2007 B15R2.1 C=Cc1cnc(nc1)N2CCOCC2 27a_100015191051_200000143982 [0,2,0,0,0,0|1,0,0]=3 2008 B15R2.1 C=Cc1cnc(nc1)N2CCSCC2 271570a_100011290941_100011939189 [0,2,0,0,0,0|1,0,0]=3 2009 B15R2.1 C=Cc1cnc(nc1)N2CCSCC2 27a_100000737611_200000143982 [0,2,0,0,0,0|1,0,0]=3 2010 B15R2.1 CCC1CCN(CC1)c2ncccn2 27a_100000754474_100000211032 [0,2,0,0,0,0|1,0,0]=3 2011 B15R2.1 CCN1CC=C(CC1)c2ncccn2 2230a_200160996789_100000210202 [0,2,0,0,0,0|1,0,1]=4 2012 B15R2.1 CCN1CC=C(CC1)c2ncccn2 269982a_200160996789_100000204670 [0,2,0,0,0,0|1,0,1]=4 2013 B15R2.1 CCN1CCC(CC1)c2ncccn2 2230a_100025774034_100000210202 [0,2,0,0,0,0|1,0,0]=3 2014 B15R2.1 CCN1CCC(CC1)c2ncccn2 269982a_100025774034_100000204670 [0,2,0,0,0,0|1,0,0]=3 2015 B15R2.1 CCN1CCN(CC1)c2ccccc2 2230a_200000209977_100000210202 [0,2,0,0,0,0|2,0,0]=4 2016 B15R2.1 CCN1CCN(CC1)c2ccccc2 269982a_200000209977_100000204670 [0,2,0,0,0,0|2,0,0]=4 2017 B15R2.1 CCN1CCN(CC1)c2ccccn2 2230a_100000736569_100000210202 [0,2,0,0,0,0|1,0,0]=3 2018 B15R2.1 CCN1CCN(CC1)c2ccccn2 269982a_100000736569_100000204670 [0,2,0,0,0,0|1,0,0]=3 2019 B15R2.1 CCN1CCN(CC1)c2cccnn2 2230a_100000749033_100000210202 [0,2,0,0,0,0|2,0,0]=4 2020 B15R2.1 CCN1CCN(CC1)c2cccnn2 269982a_100000749033_100000204670 [0,2,0,0,0,0|2,0,0]=4 2021 B15R2.1 CCN1CCN(CC1)c2cccnn2 27a_100000210033_100016991348 [0,2,0,0,0,0|2,0,0]=4 2022 B15R2.1 CCN1CCN(CC1)c2ccncn2 2230a_100016991319_100000210202 [0,2,0,0,0,0|2,0,0]=4 2023 B15R2.1 CCN1CCN(CC1)c2ccncn2 269982a_100016991319_100000204670 [0,2,0,0,0,0|2,0,0]=4 2024 B15R2.1 CCN1CCN(CC1)c2ccncn2 27a_100000210033_100000703185 [0,2,0,0,0,0|2,0,0]=4 2025 B15R2.1 CCN1CCN(CC1)c2cnccn2 2230a_100000243169_100000210202 [0,2,0,0,0,0|2,0,0]=4 2026 B15R2.1 CCN1CCN(CC1)c2cnccn2 269982a_100000243169_100000204670 [0,2,0,0,0,0|2,0,0]=4 2027 B15R2.1 CCN1CCN(CC1)c2cnccn2 27a_100000210033_100000211759 [0,2,0,0,0,0|2,0,0]=4 2028 B15R2.1 CCN1CCN(CC1)c2ncccn2 2230a_100000211082_100000210202 [0,2,0,0,0,0|0,0,0]=2 2029 B15R2.1 CCN1CCN(CC1)c2ncccn2 269982a_100000211082_100000204670 [0,2,0,0,0,0|0,0,0]=2 2030 B15R2.1 CCN1CCN(CC1)c2ncccn2 27a_100000210033_100000211032 [0,2,0,0,0,0|0,0,0]=2 2031 B15R2.1 CCN1CCN(CC1)c2nccnn2 2230a_200000102074_100000210202 [0,2,0,0,0,0|1,0,0]=3 2032 B15R2.1 CCN1CCN(CC1)c2nccnn2 269982a_200000102074_100000204670 [0,2,0,0,0,0|1,0,0]=3 2033 B15R2.1 CCN1CCN(CC1)c2ncncn2 2230a_200000041971_100000210202 [0,2,0,0,0,0|1,0,0]=3 2034 B15R2.1 CCN1CCN(CC1)c2ncncn2 269982a_200000041971_100000204670 [0,2,0,0,0,0|1,0,0]=3 2035 B15R2.1 CCc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000033099 [0,2,0,0,0,0|1,0,1]=4 2036 B15R2.1 CCc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000033099 [0,2,0,0,0,0|1,0,1]=4 2037 B15R2.1 CCc1cnc(nc1)N2CCOCC2 27a_100015191051_100000033099 [0,2,0,0,0,0|1,0,0]=3 2038 B15R2.1 CCc1cnc(nc1)N2CCSCC2 27a_100000737611_100000033099 [0,2,0,0,0,0|1,0,0]=3 2039 B15R2.1 CNC1CCN(CC1)c2ccccn2 2230a_100000739788_200000210301 [0,2,0,0,0,0|2,0,0]=4 2040 B15R2.1 CNC1CCN(CC1)c2ccccn2 270004a_106832991635_100000155999 [0,2,0,0,0,0|2,0,0]=4 2041 B15R2.1 CNC1CCN(CC1)c2ncccn2 2230a_100015184054_200000210301 [0,2,0,0,0,0|1,0,0]=3 2042 B15R2.1 CNC1CCN(CC1)c2ncccn2 270004a_106832991635_100000156000 [0,2,0,0,0,0|1,0,0]=3 2043 B15R2.1 COC1CCN(CC1)c2ccccn2 7a_102515433014_200000210301 [0,2,0,0,0,0|2,0,0]=4 2044 B15R2.1 COC1CCN(CC1)c2ncccn2 27a_100000234800_100000211032 [0,2,0,0,0,0|1,0,0]=3 2045 B15R2.1 COc1ccc(cc1)N2CCNCC2 34a_100000183656_200000210301 [0,2,0,0,0,0|2,0,0]=4 2046 B15R2.1 COc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000069167 [0,2,0,0,0,0|1,0,1]=4 2047 B15R2.1 COc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000069167 [0,2,0,0,0,0|1,0,1]=4 2048 B15R2.1 COc1cnc(nc1)N2CCOCC2 27a_100015191051_100000069167 [0,2,0,0,0,0|1,0,0]=3 2049 B15R2.1 COc1cnc(nc1)N2CCSCC2 27a_100000737611_100000069167 [0,2,0,0,0,0|1,0,0]=3 2050 B15R2.1 CSC1CCN(CC1)c2ncccn2 27a_100015202541_100000211032 [0,2,0,0,0,0|1,0,0]=3 2051 B15R2.1 CSc1ccc(cc1)N2CCNCC2 62a_100011236372_200000210301 [0,2,0,0,0,0|2,0,0]=4 2052 B15R2.1 CSc1ccc(cc1)N2CCNCC2 62a_200000210301_100011236372 [0,2,0,0,0,0|2,0,0]=4 2053 B15R2.1 CSc1ccc(nc1)N2CCCCC2 62a_200000210301_200102616235 [0,2,0,0,0,0|2,0,0]=4 2054 B15R2.1 CSc1ccc(nc1)N2CCCCC2 62a_200102616235_200000210301 [0,2,0,0,0,0|2,0,0]=4 2055 B15R2.1 CSc1ccc(nc1)N2CCNCC2 62a_100000739387_200000210301 [0,2,0,0,0,0|1,0,0]=3 2056 B15R2.1 CSc1ccc(nc1)N2CCNCC2 62a_200000210301_100000739387 [0,2,0,0,0,0|1,0,0]=3 2057 B15R2.1 CSc1ccc(nc1)N2CCOCC2 27a_100015191051_100009820866 [0,2,0,0,0,0|2,0,0]=4 2058 B15R2.1 CSc1ccc(nc1)N2CCOCC2 62a_100011465330_200000210301 [0,2,0,0,0,0|2,0,0]=4 2059 B15R2.1 CSc1ccc(nc1)N2CCOCC2 62a_200000210301_100011465330 [0,2,0,0,0,0|2,0,0]=4 2060 B15R2.1 CSc1ccc(nc1)N2CCSCC2 27a_100000737611_100009820866 [0,2,0,0,0,0|2,0,0]=4 2061 B15R2.1 CSc1ccc(nn1)N2CCNCC2 62a_100000736700_200000210301 [0,2,0,0,0,0|2,0,0]=4 2062 B15R2.1 CSc1ccc(nn1)N2CCNCC2 62a_200000210301_100000736700 [0,2,0,0,0,0|2,0,0]=4 2063 B15R2.1 CSc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000718988 [0,2,0,0,0,0|1,0,1]=4 2064 B15R2.1 CSc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000718988 [0,2,0,0,0,0|1,0,1]=4 2065 B15R2.1 CSc1cnc(nc1)N2CCCCC2 62a_100011934054_200000210301 [0,2,0,0,0,0|1,0,0]=3 2066 B15R2.1 CSc1cnc(nc1)N2CCCCC2 62a_200000210301_100011934054 [0,2,0,0,0,0|1,0,0]=3 2067 B15R2.1 CSc1cnc(nc1)N2CCNCC2 62a_100000739398_200000210301 [0,2,0,0,0,0|0,0,0]=2 2068 B15R2.1 CSc1cnc(nc1)N2CCNCC2 62a_200000210301_100000739398 [0,2,0,0,0,0|0,0,0]=2 2069 B15R2.1 CSc1cnc(nc1)N2CCOCC2 27a_100015191051_100000718988 [0,2,0,0,0,0|1,0,0]=3 2070 B15R2.1 CSc1cnc(nc1)N2CCOCC2 62a_100011397833_200000210301 [0,2,0,0,0,0|1,0,0]=3 2071 B15R2.1 CSc1cnc(nc1)N2CCOCC2 62a_200000210301_100011397833 [0,2,0,0,0,0|1,0,0]=3 2072 B15R2.1 CSc1cnc(nc1)N2CCSCC2 27a_100000737611_100000718988 [0,2,0,0,0,0|1,0,0]=3 2073 B15R2.1 CSc1cnc(nc1)N2CCSCC2 62a_100011939189_200000210301 [0,2,0,0,0,0|1,0,0]=3 2074 B15R2.1 CSc1cnc(nc1)N2CCSCC2 62a_200000210301_100011939189 [0,2,0,0,0,0|1,0,0]=3 2075 B15R2.1 FCC1CCN(CC1)c2ncccn2 27a_100015203933_100000211032 [0,2,0,0,0,0|1,0,0]=3 2076 B15R2.1 FCN1CC=C(CC1)c2ncccn2 269982a_200160996789_100015361967 [0,2,0,0,0,0|1,0,1]=4 2077 B15R2.1 FCN1CCC(CC1)c2ncccn2 269982a_100025774034_100015361967 [0,2,0,0,0,0|1,0,0]=3 2078 B15R2.1 FCN1CCN(CC1)c2ccccc2 269982a_200000209977_100015361967 [0,2,0,0,0,0|2,0,0]=4 2079 B15R2.1 FCN1CCN(CC1)c2ccccn2 269982a_100000736569_100015361967 [0,2,0,0,0,0|1,0,0]=3 2080 B15R2.1 FCN1CCN(CC1)c2cccnn2 269982a_100000749033_100015361967 [0,2,0,0,0,0|2,0,0]=4 2081 B15R2.1 FCN1CCN(CC1)c2ccncn2 269982a_100016991319_100015361967 [0,2,0,0,0,0|2,0,0]=4 2082 B15R2.1 FCN1CCN(CC1)c2cnccn2 269982a_100000243169_100015361967 [0,2,0,0,0,0|2,0,0]=4 2083 B15R2.1 FCN1CCN(CC1)c2ncccn2 269982a_100000211082_100015361967 [0,2,0,0,0,0|0,0,0]=2 2084 B15R2.1 FCN1CCN(CC1)c2nccnn2 269982a_200000102074_100015361967 [0,2,0,0,0,0|1,0,0]=3 2085 B15R2.1 FCN1CCN(CC1)c2ncncn2 269982a_200000041971_100015361967 [0,2,0,0,0,0|1,0,0]=3 2086 B15R2.1 N#CC1CCN(CC1)c2ncccn2 27a_100000747632_100000211032 [0,2,0,0,0,0|1,0,0]=3 2087 B15R2.1 N#Cc1ccc(nc1)N2CCOCC2 27a_100015191051_100000241038 [0,2,0,0,0,0|2,0,0]=4 2088 B15R2.1 N#Cc1ccc(nc1)N2CCSCC2 27a_100000737611_100000241038 [0,2,0,0,0,0|2,0,0]=4 2089 B15R2.1 N#Cc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000099682 [0,2,0,0,0,0|1,0,1]=4 2090 B15R2.1 N#Cc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000099682 [0,2,0,0,0,0|1,0,1]=4 2091 B15R2.1 N#Cc1cnc(nc1)N2CCOCC2 27a_100015191051_100000099682 [0,2,0,0,0,0|1,0,0]=3 2092 B15R2.1 N#Cc1cnc(nc1)N2CCSCC2 27a_100000737611_100000099682 [0,2,0,0,0,0|1,0,0]=3 2093 B15R2.1 O=Cc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100000070856 [0,2,0,0,0,0|1,0,1]=4 2094 B15R2.1 O=Cc1cnc(nc1)N2CC=CCC2 27a_100000698166_100000070856 [0,2,0,0,0,0|1,0,1]=4 2095 B15R2.1 O=Cc1cnc(nc1)N2CCOCC2 27a_100015191051_100000070856 [0,2,0,0,0,0|1,0,0]=3 2096 B15R2.1 O=Cc1cnc(nc1)N2CCSCC2 27a_100000737611_100000070856 [0,2,0,0,0,0|1,0,0]=3 2097 B15R2.1 OCC1CCN(CC1)c2ncccn2 27a_100000738675_100000211032 [0,2,0,0,0,0|1,0,0]=3 2098 B15R2.1 OCc1cnc(nc1)C2=CCNCC2 271570a_100000731432_100009855073 [0,2,0,0,0,0|1,0,1]=4 2099 B15R2.1 OCc1cnc(nc1)N2CC=CCC2 27a_100000698166_100009855073 [0,2,0,0,0,0|1,0,1]=4 2100 B15R2.1 OCc1cnc(nc1)N2CCOCC2 27a_100015191051_100009855073 [0,2,0,0,0,0|1,0,0]=3 2101 B15R2.1 OCc1cnc(nc1)N2CCSCC2 27a_100000737611_100009855073 [0,2,0,0,0,0|1,0,0]=3 2102 B15R2.1 [13CH3]NC1CCN(CC1)c2ccccn2 2230a_100000739788_200025704644 [0,2,0,0,0,0|2,0,0]=4 2103 B15R2.1 [13CH3]NC1CCN(CC1)c2ncccn2 2230a_100015184054_200025704644 [0,2,0,0,0,0|1,0,0]=3 2104 B15R2.1 [13CH3]OC1CCN(CC1)c2ccccn2 7a_102515433014_200025704644 [0,2,0,0,0,0|2,0,0]=4 2105 B15R2.1 [13CH3]Oc1ccc(cc1)N2CCNCC2 34a_100000183656_200025704644 [0,2,0,0,0,0|2,0,0]=4 2106 B15R2.1 [13CH3]Sc1ccc(cc1)N2CCNCC2 62a_100011236372_200025704644 [0,2,0,0,0,0|2,0,0]=4 2107 B15R2.1 [13CH3]Sc1ccc(cc1)N2CCNCC2 62a_200025704644_100011236372 [0,2,0,0,0,0|2,0,0]=4 2108 B15R2.1 [13CH3]Sc1ccc(nc1)N2CCCCC2 62a_200025704644_200102616235 [0,2,0,0,0,0|2,0,0]=4 2109 B15R2.1 [13CH3]Sc1ccc(nc1)N2CCCCC2 62a_200102616235_200025704644 [0,2,0,0,0,0|2,0,0]=4 2110 B15R2.1 [13CH3]Sc1ccc(nc1)N2CCNCC2 62a_100000739387_200025704644 [0,2,0,0,0,0|1,0,0]=3 2111 B15R2.1 [13CH3]Sc1ccc(nc1)N2CCNCC2 62a_200025704644_100000739387 [0,2,0,0,0,0|1,0,0]=3 2112 B15R2.1 [13CH3]Sc1ccc(nc1)N2CCOCC2 62a_100011465330_200025704644 [0,2,0,0,0,0|2,0,0]=4 2113 B15R2.1 [13CH3]Sc1ccc(nc1)N2CCOCC2 62a_200025704644_100011465330 [0,2,0,0,0,0|2,0,0]=4 2114 B15R2.1 [13CH3]Sc1ccc(nn1)N2CCNCC2 62a_100000736700_200025704644 [0,2,0,0,0,0|2,0,0]=4 2115 B15R2.1 [13CH3]Sc1ccc(nn1)N2CCNCC2 62a_200025704644_100000736700 [0,2,0,0,0,0|2,0,0]=4 2116 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCCCC2 62a_100011934054_200025704644 [0,2,0,0,0,0|1,0,0]=3 2117 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCCCC2 62a_200025704644_100011934054 [0,2,0,0,0,0|1,0,0]=3 2118 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCNCC2 62a_100000739398_200025704644 [0,2,0,0,0,0|0,0,0]=2 2119 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCNCC2 62a_200025704644_100000739398 [0,2,0,0,0,0|0,0,0]=2 2120 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCOCC2 62a_100011397833_200025704644 [0,2,0,0,0,0|1,0,0]=3 2121 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCOCC2 62a_200025704644_100011397833 [0,2,0,0,0,0|1,0,0]=3 2122 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCSCC2 62a_100011939189_200025704644 [0,2,0,0,0,0|1,0,0]=3 2123 B15R2.1 [13CH3]Sc1cnc(nc1)N2CCSCC2 62a_200025704644_100011939189 [0,2,0,0,0,0|1,0,0]=3 2124 B15R2.3 C=C1CCN(CC1)c2ccc(cn2)Br 27a_100000752442_100000686858 [0,2,0,0,0,0|2,0,0]=4 2125 B15R2.3 C=C1CCN(CC1)c2ncc(cn2)Br 27a_100000752442_100000690281 [0,2,0,0,0,0|1,0,0]=3 2126 B15R2.3 C=C1CCN(CC1)c2ncc(cn2)C 27a_100000752442_100000061069 [0,2,0,0,0,0|1,0,0]=3 2127 B15R2.3 C=C1CCN(CC1)c2ncc(cn2)Cl 27a_100000752442_100011356929 [0,2,0,0,0,0|1,0,0]=3 2128 B15R2.3 C=C1CCN(CC1)c2ncc(cn2)F 27a_100000752442_100000685220 [0,2,0,0,0,0|1,0,0]=3 2129 B15R2.3 CC1=CCN(CC1)c2ncc(cn2)Br 27a_100000693516_100000690281 [0,2,0,0,0,0|1,0,1]=4 2130 B15R2.3 CC1=CCN(CC1)c2ncc(cn2)C 27a_100000693516_100000061069 [0,2,0,0,0,0|1,0,1]=4 2131 B15R2.3 CC1=CCN(CC1)c2ncc(cn2)Cl 27a_100000693516_100011356929 [0,2,0,0,0,0|1,0,1]=4 2132 B15R2.3 CC1=CCN(CC1)c2ncc(cn2)F 27a_100000693516_100000685220 [0,2,0,0,0,0|1,0,1]=4 2133 B15R2.3 CC1CCN(CC1)c2ccc(cn2)Br 27a_100000188429_100000686858 [0,2,0,0,0,0|2,0,0]=4 2134 B15R2.3 CC1CCN(CC1)c2ccc(cn2)O 271570a_203496583355_200011256012 [0,2,0,0,0,0|2,0,0]=4 2135 B15R2.3 CC1CCN(CC1)c2ncc(cn2)Br 27a_100000188429_100000690281 [0,2,0,0,0,0|1,0,0]=3 2136 B15R2.3 CC1CCN(CC1)c2ncc(cn2)Cl 27a_100000188429_100011356929 [0,2,0,0,0,0|1,0,0]=3 2137 B15R2.3 CC1CCN(CC1)c2ncc(cn2)F 27a_100000188429_100000685220 [0,2,0,0,0,0|1,0,0]=3 2138 B15R2.3 CN1CCN(CC1)c2ccc(=O)[nH]n2 2230a_100000754449_200000210301 [0,2,0,0,0,0|2,0,0]=4 2139 B15R2.3 CN1CCN(CC1)c2ccc(=O)[nH]n2 269982a_100000754449_200000210301 [0,2,0,0,0,0|2,0,0]=4 2140 B15R2.3 CN1CCN(CC1)c2ccc(cc2)Br 2230a_100000026148_200000210301 [0,2,0,0,0,0|2,0,0]=4 2141 B15R2.3 CN1CCN(CC1)c2ccc(cc2)Br 269982a_100000026148_200000210301 [0,2,0,0,0,0|2,0,0]=4 2142 B15R2.3 CN1CCN(CC1)c2ccc(cc2)Br 34a_100000026148_200000210301 [0,2,0,0,0,0|2,0,0]=4 2143 B15R2.3 CN1CCN(CC1)c2ccc(cc2)F 2230a_200000209892_200000210301 [0,2,0,0,0,0|2,0,0]=4 2144 B15R2.3 CN1CCN(CC1)c2ccc(cc2)F 269982a_200000209892_200000210301 [0,2,0,0,0,0|2,0,0]=4 2145 B15R2.3 CN1CCN(CC1)c2ccc(cc2)F 34a_200000209892_200000210301 [0,2,0,0,0,0|2,0,0]=4 2146 B15R2.3 CN1CCN(CC1)c2ccc(cc2)I 2230a_100011236372_200000210301 [0,2,0,0,0,0|2,0,0]=4 2147 B15R2.3 CN1CCN(CC1)c2ccc(cc2)I 269982a_100011236372_200000210301 [0,2,0,0,0,0|2,0,0]=4 2148 B15R2.3 CN1CCN(CC1)c2ccc(cc2)O 2230a_100000183656_200000210301 [0,2,0,0,0,0|2,0,0]=4 2149 B15R2.3 CN1CCN(CC1)c2ccc(cc2)O 269982a_100000183656_200000210301 [0,2,0,0,0,0|2,0,0]=4 2150 B15R2.3 CN1CCN(CC1)c2ccc(cc2)O 271570a_203496583355_102125399612 [0,2,0,0,0,0|2,0,0]=4 2151 B15R2.3 CN1CCN(CC1)c2ccc(cc2)O 34a_100000183656_200000210301 [0,2,0,0,0,0|2,0,0]=4 2152 B15R2.3 CN1CCN(CC1)c2ccc(cn2)Br 2230a_100000739387_200000210301 [0,2,0,0,0,0|1,0,0]=3 2153 B15R2.3 CN1CCN(CC1)c2ccc(cn2)Br 269982a_100000739387_200000210301 [0,2,0,0,0,0|1,0,0]=3 2154 B15R2.3 CN1CCN(CC1)c2ccc(cn2)Br 27a_100000188432_100000686858 [0,2,0,0,0,0|1,0,0]=3 2155 B15R2.3 CN1CCN(CC1)c2ccc(cn2)Cl 2230a_100000746275_200000210301 [0,2,0,0,0,0|1,0,0]=3 2156 B15R2.3 CN1CCN(CC1)c2ccc(cn2)Cl 269982a_100000746275_200000210301 [0,2,0,0,0,0|1,0,0]=3 2157 B15R2.3 CN1CCN(CC1)c2ccc(cn2)F 2230a_100020590332_200000210301 [0,2,0,0,0,0|1,0,0]=3 2158 B15R2.3 CN1CCN(CC1)c2ccc(cn2)F 269982a_100020590332_200000210301 [0,2,0,0,0,0|1,0,0]=3 2159 B15R2.3 CN1CCN(CC1)c2ccc(cn2)I 2230a_107254836660_200000210301 [0,2,0,0,0,0|1,0,0]=3 2160 B15R2.3 CN1CCN(CC1)c2ccc(cn2)I 269982a_107254836660_200000210301 [0,2,0,0,0,0|1,0,0]=3 2161 B15R2.3 CN1CCN(CC1)c2ccc(cn2)O 271570a_203496583355_100011290668 [0,2,0,0,0,0|1,0,0]=3 2162 B15R2.3 CN1CCN(CC1)c2ccc(nn2)Cl 2230a_100000736700_200000210301 [0,2,0,0,0,0|2,0,0]=4 2163 B15R2.3 CN1CCN(CC1)c2ccc(nn2)Cl 269982a_100000736700_200000210301 [0,2,0,0,0,0|2,0,0]=4 2164 B15R2.3 CN1CCN(CC1)c2cnc(cn2)Br 27a_100000188432_100010187541 [0,2,0,0,0,0|2,0,0]=4 2165 B15R2.3 CN1CCN(CC1)c2cnc(cn2)F 27a_100000188432_100009856528 [0,2,0,0,0,0|2,0,0]=4 2166 B15R2.3 CN1CCN(CC1)c2ncc(cn2)Br 2230a_100000739398_200000210301 [0,2,0,0,0,0|0,0,0]=2 2167 B15R2.3 CN1CCN(CC1)c2ncc(cn2)Br 269982a_100000739398_200000210301 [0,2,0,0,0,0|0,0,0]=2 2168 B15R2.3 CN1CCN(CC1)c2ncc(cn2)Br 27a_100000188432_100000690281 [0,2,0,0,0,0|0,0,0]=2 2169 B15R2.3 CN1CCN(CC1)c2ncc(cn2)Cl 27a_100000188432_100011356929 [0,2,0,0,0,0|0,0,0]=2 2170 B15R2.3 CN1CCN(CC1)c2ncc(cn2)F 27a_100000188432_100000685220 [0,2,0,0,0,0|0,0,0]=2 2171 B15R2.3 CN1CCN(CC1)c2ncc(cn2)O 271570a_203496583355_100011290728 [0,2,0,0,0,0|0,0,0]=2 2172 B15R2.3 Cc1ccc(cc1)N2CCN(CC2)C 2230a_100000700560_200000210301 [0,2,0,0,0,0|2,0,0]=4 2173 B15R2.3 Cc1ccc(cc1)N2CCN(CC2)C 269982a_100000700560_200000210301 [0,2,0,0,0,0|2,0,0]=4 2174 B15R2.3 Cc1ccc(cc1)N2CCN(CC2)C 34a_100000700560_200000210301 [0,2,0,0,0,0|2,0,0]=4 2175 B15R2.3 Cc1ccc(cc1)N2CCN(CC2)[13CH3] 2230a_100000700560_200025704644 [0,2,0,0,0,0|2,0,0]=4 2176 B15R2.3 Cc1ccc(cc1)N2CCN(CC2)[13CH3] 269982a_100000700560_200025704644 [0,2,0,0,0,0|2,0,0]=4 2177 B15R2.3 Cc1ccc(cc1)N2CCN(CC2)[13CH3] 34a_100000700560_200025704644 [0,2,0,0,0,0|2,0,0]=4 2178 B15R2.3 Cc1ccc(nc1)N2CCN(CC2)C 2230a_100011193482_200000210301 [0,2,0,0,0,0|1,0,0]=3 2179 B15R2.3 Cc1ccc(nc1)N2CCN(CC2)C 269982a_100011193482_200000210301 [0,2,0,0,0,0|1,0,0]=3 2180 B15R2.3 Cc1ccc(nc1)N2CCN(CC2)[13CH3] 2230a_100011193482_200025704644 [0,2,0,0,0,0|1,0,0]=3 2181 B15R2.3 Cc1ccc(nc1)N2CCN(CC2)[13CH3] 269982a_100011193482_200025704644 [0,2,0,0,0,0|1,0,0]=3 2182 B15R2.3 Cc1ccc(nn1)N2CCN(CC2)C 2230a_200011449907_200000210301 [0,2,0,0,0,0|2,0,0]=4 2183 B15R2.3 Cc1ccc(nn1)N2CCN(CC2)C 269982a_200011449907_200000210301 [0,2,0,0,0,0|2,0,0]=4 2184 B15R2.3 Cc1ccc(nn1)N2CCN(CC2)C 27a_100000188432_100000744512 [0,2,0,0,0,0|2,0,0]=4 2185 B15R2.3 Cc1ccc(nn1)N2CCN(CC2)[13CH3] 2230a_200011449907_200025704644 [0,2,0,0,0,0|2,0,0]=4 2186 B15R2.3 Cc1ccc(nn1)N2CCN(CC2)[13CH3] 269982a_200011449907_200025704644 [0,2,0,0,0,0|2,0,0]=4 2187 B15R2.3 Cc1cnc(cn1)N2CCN(CC2)C 27a_100000188432_100000074397 [0,2,0,0,0,0|2,0,0]=4 2188 B15R2.3 Cc1cnc(nc1)N2CCC(CC2)C 27a_100000188429_100000061069 [0,2,0,0,0,0|1,0,0]=3 2189 B15R2.3 Cc1cnc(nc1)N2CCC(CC2)F 27a_100015193889_100000061069 [0,2,0,0,0,0|1,0,0]=3 2190 B15R2.3 Cc1cnc(nc1)N2CCC(CC2)O 27a_100025773856_100000061069 [0,2,0,0,0,0|1,0,0]=3 2191 B15R2.3 Cc1cnc(nc1)N2CCN(CC2)C 27a_100000188432_100000061069 [0,2,0,0,0,0|0,0,0]=2 2192 B15R2.3 Cc1cnc(nc1)N2CCS(=O)CC2 27a_100000752083_100000061069 [0,2,0,0,0,0|1,0,0]=3 2193 B15R2.3 FC1CCN(CC1)c2ccc(cn2)Br 27a_100015193889_100000686858 [0,2,0,0,0,0|2,0,0]=4 2194 B15R2.3 FC1CCN(CC1)c2ncc(cn2)Br 27a_100015193889_100000690281 [0,2,0,0,0,0|1,0,0]=3 2195 B15R2.3 FC1CCN(CC1)c2ncc(cn2)Cl 27a_100015193889_100011356929 [0,2,0,0,0,0|1,0,0]=3 2196 B15R2.3 Fc1cnc(nc1)N2CCC(CC2)F 27a_100015193889_100000685220 [0,2,0,0,0,0|1,0,0]=3 2197 B15R2.3 O=C1CCN(CC1)c2ncc(cn2)O 271570a_203496583355_100011938725 [0,2,0,0,0,0|1,0,0]=3 2198 B15R2.3 O=S1CCN(CC1)c2ccc(cn2)Br 27a_100000752083_100000686858 [0,2,0,0,0,0|2,0,0]=4 2199 B15R2.3 O=S1CCN(CC1)c2ncc(cn2)Br 27a_100000752083_100000690281 [0,2,0,0,0,0|1,0,0]=3 2200 B15R2.3 O=S1CCN(CC1)c2ncc(cn2)Cl 27a_100000752083_100011356929 [0,2,0,0,0,0|1,0,0]=3 2201 B15R2.3 O=S1CCN(CC1)c2ncc(cn2)F 27a_100000752083_100000685220 [0,2,0,0,0,0|1,0,0]=3 2202 B15R2.3 OC1CCN(CC1)c2ccc(cn2)Br 27a_100025773856_100000686858 [0,2,0,0,0,0|2,0,0]=4 2203 B15R2.3 OC1CCN(CC1)c2ncc(cn2)Br 27a_100025773856_100000690281 [0,2,0,0,0,0|1,0,0]=3 2204 B15R2.3 OC1CCN(CC1)c2ncc(cn2)Cl 27a_100025773856_100011356929 [0,2,0,0,0,0|1,0,0]=3 2205 B15R2.3 OC1CCN(CC1)c2ncc(cn2)F 27a_100025773856_100000685220 [0,2,0,0,0,0|1,0,0]=3 2206 B15R2.3 Oc1ccc(nc1)N2CCC(CC2)O 271570a_203496583355_100011421273 [0,2,0,0,0,0|2,0,0]=4 2207 B15R2.3 Oc1cnc(nc1)N2CCC(CC2)O 271570a_203496583355_100011938973 [0,2,0,0,0,0|1,0,0]=3 2208 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(=O)[nH]n2 2230a_100000754449_200025704644 [0,2,0,0,0,0|2,0,0]=4 2209 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(=O)[nH]n2 269982a_100000754449_200025704644 [0,2,0,0,0,0|2,0,0]=4 2210 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)Br 2230a_100000026148_200025704644 [0,2,0,0,0,0|2,0,0]=4 2211 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)Br 269982a_100000026148_200025704644 [0,2,0,0,0,0|2,0,0]=4 2212 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)Br 34a_100000026148_200025704644 [0,2,0,0,0,0|2,0,0]=4 2213 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)F 2230a_200000209892_200025704644 [0,2,0,0,0,0|2,0,0]=4 2214 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)F 269982a_200000209892_200025704644 [0,2,0,0,0,0|2,0,0]=4 2215 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)F 34a_200000209892_200025704644 [0,2,0,0,0,0|2,0,0]=4 2216 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)I 2230a_100011236372_200025704644 [0,2,0,0,0,0|2,0,0]=4 2217 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)I 269982a_100011236372_200025704644 [0,2,0,0,0,0|2,0,0]=4 2218 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)O 2230a_100000183656_200025704644 [0,2,0,0,0,0|2,0,0]=4 2219 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)O 269982a_100000183656_200025704644 [0,2,0,0,0,0|2,0,0]=4 2220 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cc2)O 34a_100000183656_200025704644 [0,2,0,0,0,0|2,0,0]=4 2221 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)Br 2230a_100000739387_200025704644 [0,2,0,0,0,0|1,0,0]=3 2222 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)Br 269982a_100000739387_200025704644 [0,2,0,0,0,0|1,0,0]=3 2223 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)Cl 2230a_100000746275_200025704644 [0,2,0,0,0,0|1,0,0]=3 2224 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)Cl 269982a_100000746275_200025704644 [0,2,0,0,0,0|1,0,0]=3 2225 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)F 2230a_100020590332_200025704644 [0,2,0,0,0,0|1,0,0]=3 2226 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)F 269982a_100020590332_200025704644 [0,2,0,0,0,0|1,0,0]=3 2227 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)I 2230a_107254836660_200025704644 [0,2,0,0,0,0|1,0,0]=3 2228 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(cn2)I 269982a_107254836660_200025704644 [0,2,0,0,0,0|1,0,0]=3 2229 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(nn2)Cl 2230a_100000736700_200025704644 [0,2,0,0,0,0|2,0,0]=4 2230 B15R2.3 [13CH3]N1CCN(CC1)c2ccc(nn2)Cl 269982a_100000736700_200025704644 [0,2,0,0,0,0|2,0,0]=4 2231 B15R2.3 [13CH3]N1CCN(CC1)c2ncc(cn2)Br 2230a_100000739398_200025704644 [0,2,0,0,0,0|0,0,0]=2 2232 B15R2.3 [13CH3]N1CCN(CC1)c2ncc(cn2)Br 269982a_100000739398_200025704644 [0,2,0,0,0,0|0,0,0]=2 2233 B15R2.96 CN1CCC(CC1)(O)c2ccccn2 2230a_100015187447_200000210301 [0,2,0,0,0,0|2,0,0]=4 2234 B15R2.96 CN1CCC(CC1)(O)c2ccccn2 269982a_100015187447_200000210301 [0,2,0,0,0,0|2,0,0]=4 2235 B15R2.96 [13CH3]N1CCC(CC1)(O)c2ccccn2 2230a_100015187447_200025704644 [0,2,0,0,0,0|2,0,0]=4 2236 B15R2.96 [13CH3]N1CCC(CC1)(O)c2ccccn2 269982a_100015187447_200025704644 [0,2,0,0,0,0|2,0,0]=4 2237 B15R2.467 CC1(CCN(CC1)c2ncccn2)C 27a_100000750138_100000211032 [0,2,0,0,0,0|1,0,0]=3 2238 B15R2.467 CC1(CCN(CC1)c2ncccn2)O 27a_100000690209_100000211032 [0,2,0,0,0,0|1,0,0]=3 2239 B15R2.467 C[Si]1(CCN(CC1)c2ncccn2)C 27a_100025715224_100000211032 [0,2,0,0,0,0|1,0,0]=3 2240 B15R2.467 FC1(CCN(CC1)c2ncccn2)F 27a_100000724815_100000211032 [0,2,0,0,0,0|1,0,0]=3 2241 B15R2.467 O=S1(=O)CCN(CC1)c2ncccn2 27a_100000750940_100000211032 [0,2,0,0,0,0|1,0,0]=3 2242 B15R2.467 OC1(CCN(CC1)c2ncccn2)O 27a_100016987284_100000211032 [0,2,0,0,0,0|1,0,0]=3 2243 B13R2.373 C[C@H]1[C@H](CN1c2ncccn2)O 27a_206633788156_100000211032 [0,0,1,1,0,0|1,0,0]=3 2244 B13R2.679 CCN(c1ncccn1)C2CC2 27a_100000738653_100000211032 [0,0,1,1,0,0|1,0,0]=3 2245 B13R2.64 C1=CCC(C1)Nc2ncccn2 27a_100015188752_100000211032 [0,0,1,1,0,0|1,0,1]=4 2246 B13R2.64 c1cnc(nc1)NC2CCCC2 27a_100000211070_100000211032 [0,0,1,1,0,0|1,0,0]=3 2247 B13R2.64 c1cnc(nc1)N[C@@H]2CCOC2 27a_200015188469_100000211032 [0,0,1,1,0,0|1,0,0]=3 2248 B13R2.64 c1cnc(nc1)N[C@H]2CCOC2 27a_100015188467_100000211032 [0,0,1,1,0,0|1,0,0]=3 2249 B13R2.64 c1cnc(nc1)SC2CCCC2 62a_100000211032_100000179811 [0,0,1,1,0,0|2,0,0]=4 2250 B13R2.64 c1cnc(nc1)SC2CCCC2 62a_100011217020_100000211032 [0,0,1,1,0,0|2,0,0]=4 2251 B13R2.64 c1cnc(nc1)SC2CCOC2 62a_100000211032_100000690089 [0,0,1,1,0,0|2,0,0]=4 2252 B13R2.2382 c1cnc(nc1)NCCC2CC2 27a_100000764129_100000211032 [0,0,1,1,0,0|1,0,0]=3 2253 B13R2.2382 c1cnc(nc1)SCCC2CC2 62a_100000211032_100000764125 [0,0,1,1,0,0|2,0,0]=4 2254 B13R2.2382 c1cnc(nc1)SCCC2CC2 62a_100000764125_100000211032 [0,0,1,1,0,0|2,0,0]=4 2255 B13R2.2383 c1cnc(nc1)NCC2CCC2 27a_100000738700_100000211032 [0,0,1,1,0,0|1,0,0]=3 2256 B13R2.2383 c1cnc(nc1)NCC2COC2 27a_100015281925_100000211032 [0,0,1,1,0,0|2,0,0]=4 2257 B13R2.2383 c1cnc(nc1)NC[C@@H]2CCO2 27a_100020831831_100000211032 [0,0,1,1,0,0|1,0,0]=3 2258 B13R2.2383 c1cnc(nc1)SCC2CCC2 62a_100000211032_100000763275 [0,0,1,1,0,0|2,0,0]=4 2259 B13R2.2383 c1cnc(nc1)SCC2CCC2 62a_100000763275_100000211032 [0,0,1,1,0,0|2,0,0]=4 2260 B13R2.2383 c1cnc(nc1)SCC2CCO2 62a_100000103362_100000211032 [0,0,1,1,0,0|2,0,0]=4 2261 B13R2.2383 c1cnc(nc1)SCC2CCO2 62a_100000211032_100000103362 [0,0,1,1,0,0|2,0,0]=4 2262 B13R2.52 CCC1CN(C1)c2ncccn2 27a_100015205115_100000211032 [0,0,1,1,0,0|1,0,0]=3 2263 B13R2.52 COC1CN(C1)c2ncccn2 27a_100000755009_100000211032 [0,0,1,1,0,0|1,0,0]=3 2264 B13R2.52 CSC1CN(C1)c2ncccn2 27a_100016990038_100000211032 [0,0,1,1,0,0|1,0,0]=3 2265 B13R2.52 FCC1CN(C1)c2ncccn2 27a_100010363649_100000211032 [0,0,1,1,0,0|2,0,0]=4 2266 B13R2.52 N#CC1CN(C1)c2ncccn2 27a_100015195279_100000211032 [0,0,1,1,0,0|2,0,0]=4 2267 B13R2.52 OCC1CN(C1)c2ncccn2 27a_100016987283_100000211032 [0,0,1,1,0,0|2,0,0]=4 2268 B13R2.690 CN(CC1CC1)c2ncccn2 27a_100000741881_100000211032 [0,0,1,1,0,0|1,0,0]=3 2269 B13R2.8137 CN(c1ncccn1)C2CCC2 27a_100000758072_100000211032 [0,0,1,1,0,0|1,0,0]=3 2270 B15R3.1724 c1ccc(nc1)CN2CC3CC3C2 2230a_100000741873_100000721315 [0,0,0,1,0,1|2,0,0]=4 2271 B15R3.1724 c1ccc(nc1)CN2CC3CC3C2 269982a_100000741873_100000721315 [0,0,0,1,0,1|2,0,0]=4 2272 B15R3.1724 c1ccc(nc1)CN2CC3CC3C2 270004a_100000741873_100000209966 [0,0,0,1,0,1|2,0,0]=4 2273 B15R3.1724 c1ccc(nc1)CN2CC3CC3C2 34a_100000741873_100000721315 [0,0,0,1,0,1|2,0,0]=4 2274 B15R3.1724 c1cnc(nc1)CN2CC3CC3C2 2230a_100000741873_100000703007 [0,0,0,1,0,1|1,0,0]=3 2275 B15R3.1724 c1cnc(nc1)CN2CC3CC3C2 269982a_100000741873_100000703007 [0,0,0,1,0,1|1,0,0]=3 2276 B15R3.1724 c1cnc(nc1)CN2CC3CC3C2 270004a_100000741873_100011532527 [0,0,0,1,0,1|1,0,0]=3 2277 B15R3.1724 c1cnc(nc1)CN2CC3CC3C2 34a_100000741873_100000703007 [0,0,0,1,0,1|1,0,0]=3 2278 B15R3.1725 c1cnc(nc1)NC2C3C2COC3 27a_100000702821_100000211032 [0,0,0,1,0,1|2,0,0]=4 2279 B15R3.4204 c1cnc(nc1)N2C3CCC2CC3 27a_100000735658_100000211032 [0,0,0,1,0,1|2,0,0]=4 2280 B15R3.4209 c1cnc(nc1)N2CC3CCC2C3 27a_100000743476_100000211032 [0,1,0,1,0,0|1,0,0]=3 2281 B15R3.4209 c1cnc(nc1)N2C[C@H]3C[C@@H]2CO3 27a_100016995552_100000211032 [0,1,0,1,0,0|1,0,0]=3 2282 B15R3.17784 Cc1ccnc(n1)N2CC3CC3C2 27a_100000741873_100000750684 [0,1,0,1,0,0|1,0,0]=3 2283 B15R3.17784 Fc1cccc(n1)N2CC3CC3C2 27a_100000741873_100009815982 [0,1,0,1,0,0|2,0,0]=4 2284 B15R3.17784 Fc1ccnc(c1)N2CC3CC3C2 27a_100000741873_100000764206 [0,1,0,1,0,0|2,0,0]=4 2285 B15R3.17784 Nc1ccnc(n1)N2CC3CC3C2 27a_100000741873_100000757536 [0,1,0,1,0,0|1,0,0]=3 2286 B15R3.17784 Nc1ncnc(n1)N2CC3CC3C2 27a_100000741873_100000123831 [0,1,0,1,0,0|2,0,0]=4 2287 B15R3.17784 Oc1ccnc(n1)N2CC3CC3C2 27a_100000741873_100011649813 [0,1,0,1,0,0|1,0,0]=3 2288 B15R3.1884 Brc1cccnc1N2CC3CC3C2 27a_100000741873_100000696092 [0,1,0,1,0,0|2,0,0]=4 2289 B15R3.1166 Brc1ccc(nc1)N2CC3CC3C2 27a_100000741873_100000686858 [0,1,0,1,0,0|2,0,0]=4 2290 B15R3.1166 Brc1cnc(nc1)N2CC3CC3C2 27a_100000741873_100000690281 [0,1,0,1,0,0|1,0,0]=3 2291 B15R3.1166 Cc1cnc(nc1)N2CC3CC3C2 27a_100000741873_100000061069 [0,1,0,1,0,0|1,0,0]=3 2292 B15R3.1166 Clc1cnc(nc1)N2CC3CC3C2 27a_100000741873_100011356929 [0,1,0,1,0,0|1,0,0]=3 2293 B15R3.1166 Fc1cnc(nc1)N2CC3CC3C2 27a_100000741873_100000685220 [0,1,0,1,0,0|1,0,0]=3 2294 B11R1.4 CCNCCCc1cccs1 2230a_100015525214_100010992444 [0,0,1,0,1,0|2,0,0]=4 2295 B11R1.4 CCNCCCn1cccn1 2230a_100015525214_100000739983 [0,0,1,0,1,0|2,0,0]=4 2296 B11R2.2 c1nnc(s1)N2CCCC2 27a_100000188435_100000739804 [0,0,0,0,2,0|2,0,0]=4 2297 B11R2.2 c1nsc(n1)N2CCCC2 27a_100000188435_100000693119 [0,0,0,0,2,0|2,0,0]=4 2298 B11R2.239 c1cc(ncn1)N2CCC2 27a_100000754969_100000703185 [0,0,0,0,2,0|2,0,0]=4 2299 B11R2.239 c1cnc(cn1)N2CCC2 27a_100000754969_100000211759 [0,0,0,0,2,0|2,0,0]=4 2300 B11R2.239 c1cnc(nc1)N2CCC2 27a_100000754969_100000211032 [0,0,0,0,2,0|0,0,0]=2 2301 B11R2.239 c1cnnc(c1)N2CCC2 27a_100000754969_100016991348 [0,0,0,0,2,0|2,0,0]=4 2302 B13R1.79 C#CCN(CC)Cc1ncccn1 2230a_100000744766_100000703007 [0,0,1,0,0,1|1,0,1]=4 2303 B13R1.79 C#CCN(CC)Cc1ncccn1 269982a_100000744766_100000703007 [0,0,1,0,0,1|1,0,1]=4 2304 B13R1.79 C#CCN(CC)Cc1ncccn1 270004a_100000744766_100011532527 [0,0,1,0,0,1|1,0,1]=4 2305 B13R1.79 CCCC(CC)Nc1ncccn1 27a_100000747048_100000211032 [0,0,1,0,0,1|2,0,0]=4 2306 B13R1.79 CCCC(CC)Sc1ncccn1 62a_100000211032_100011219200 [0,0,1,0,0,1|2,0,0]=4 2307 B13R1.79 CCCC(CC)Sc1ncccn1 62a_100011219200_100000211032 [0,0,1,0,0,1|2,0,0]=4 2308 B13R1.79 CCCN(CC)Cc1ccccn1 2230a_100000201164_100000210303 [0,0,1,0,0,1|2,0,0]=4 2309 B13R1.79 CCCN(CC)Cc1ccccn1 2230a_100000226822_100000721315 [0,0,1,0,0,1|2,0,0]=4 2310 B13R1.79 CCCN(CC)Cc1ccccn1 2230a_100160999930_100000210202 [0,0,1,0,0,1|2,0,0]=4 2311 B13R1.79 CCCN(CC)Cc1ccccn1 269982a_100000201164_100000210303 [0,0,1,0,0,1|2,0,0]=4 2312 B13R1.79 CCCN(CC)Cc1ccccn1 269982a_100000226822_100000721315 [0,0,1,0,0,1|2,0,0]=4 2313 B13R1.79 CCCN(CC)Cc1ccccn1 269982a_100160999930_100000204670 [0,0,1,0,0,1|2,0,0]=4 2314 B13R1.79 CCCN(CC)Cc1ccccn1 270004a_100000226822_100000209966 [0,0,1,0,0,1|2,0,0]=4 2315 B13R1.79 CCCN(CC)Cc1ncccn1 2230a_100000226822_100000703007 [0,0,1,0,0,1|1,0,0]=3 2316 B13R1.79 CCCN(CC)Cc1ncccn1 269982a_100000226822_100000703007 [0,0,1,0,0,1|1,0,0]=3 2317 B13R1.79 CCCN(CC)Cc1ncccn1 270004a_100000226822_100011532527 [0,0,1,0,0,1|1,0,0]=3 2318 B13R1.79 CCN(CCF)Cc1ccccn1 2230a_100000201164_100011217306 [0,0,1,0,0,1|2,0,0]=4 2319 B13R1.79 CCN(CCF)Cc1ccccn1 269982a_100000201164_100011217306 [0,0,1,0,0,1|2,0,0]=4 2320 B13R1.79 CCN(CCO)Cc1ccccn1 2230a_100000201164_100000211926 [0,0,1,0,0,1|2,0,0]=4 2321 B13R1.79 CCN(CCO)Cc1ccccn1 2230a_100000210973_100000721315 [0,0,1,0,0,1|2,0,0]=4 2322 B13R1.79 CCN(CCO)Cc1ccccn1 269982a_100000201164_100000211926 [0,0,1,0,0,1|2,0,0]=4 2323 B13R1.79 CCN(CCO)Cc1ccccn1 269982a_100000210973_100000721315 [0,0,1,0,0,1|2,0,0]=4 2324 B13R1.79 CCN(CCO)Cc1ccccn1 270004a_100000210973_100000209966 [0,0,1,0,0,1|2,0,0]=4 2325 B13R1.79 CCN(CCO)Cc1ncccn1 2230a_100000210973_100000703007 [0,0,1,0,0,1|1,0,0]=3 2326 B13R1.79 CCN(CCO)Cc1ncccn1 269982a_100000210973_100000703007 [0,0,1,0,0,1|1,0,0]=3 2327 B13R1.79 CCN(CCO)Cc1ncccn1 270004a_100000210973_100011532527 [0,0,1,0,0,1|1,0,0]=3 2328 B15R2.2167 c1ccc(nc1)CN2CCCCCC2 2230a_100000185865_100000721315 [0,0,0,0,0,2|2,0,0]=4 2329 B15R2.2167 c1ccc(nc1)CN2CCCCCC2 269982a_100000185865_100000721315 [0,0,0,0,0,2|2,0,0]=4 2330 B15R2.2167 c1ccc(nc1)CN2CCCCCC2 270004a_100000185865_100000209966 [0,0,0,0,0,2|2,0,0]=4 2331 B15R2.2167 c1ccc(nc1)CN2CCCCCC2 34a_100000185865_100000721315 [0,0,0,0,0,2|2,0,0]=4 2332 B15R2.2167 c1ccc(nc1)CN2CCCOCC2 2230a_100000685342_100000721315 [0,0,0,0,0,2|2,0,0]=4 2333 B15R2.2167 c1ccc(nc1)CN2CCCOCC2 269982a_100000685342_100000721315 [0,0,0,0,0,2|2,0,0]=4 2334 B15R2.2167 c1ccc(nc1)CN2CCCOCC2 270004a_100000685342_100000209966 [0,0,0,0,0,2|2,0,0]=4 2335 B15R2.2167 c1ccc(nc1)CN2CCCOCC2 34a_100000685342_100000721315 [0,0,0,0,0,2|2,0,0]=4 2336 B15R2.2167 c1cnc(nc1)CN2CCCCCC2 2230a_100000185865_100000703007 [0,0,0,0,0,2|1,0,0]=3 2337 B15R2.2167 c1cnc(nc1)CN2CCCCCC2 269982a_100000185865_100000703007 [0,0,0,0,0,2|1,0,0]=3 2338 B15R2.2167 c1cnc(nc1)CN2CCCCCC2 270004a_100000185865_100011532527 [0,0,0,0,0,2|1,0,0]=3 2339 B15R2.2167 c1cnc(nc1)CN2CCCCCC2 34a_100000185865_100000703007 [0,0,0,0,0,2|1,0,0]=3 2340 B15R2.2167 c1cnc(nc1)CN2CCCOCC2 2230a_100000685342_100000703007 [0,0,0,0,0,2|1,0,0]=3 2341 B15R2.2167 c1cnc(nc1)CN2CCCOCC2 269982a_100000685342_100000703007 [0,0,0,0,0,2|1,0,0]=3 2342 B15R2.2167 c1cnc(nc1)CN2CCCOCC2 270004a_100000685342_100011532527 [0,0,0,0,0,2|1,0,0]=3 2343 B15R2.2167 c1cnc(nc1)CN2CCCOCC2 34a_100000685342_100000703007 [0,0,0,0,0,2|1,0,0]=3 2344 B15R2.2167 c1cnc(nc1)NC2CCCCCC2 27a_100000210984_100000211032 [0,0,0,0,0,2|2,0,0]=4 2345 B15R2.2167 c1cnc(nc1)SC2CCCCCC2 62a_100000211032_100011217769 [0,0,0,0,0,2|2,0,0]=4 2346 B15R2.2167 c1cnc(nc1)SC2CCCCCC2 62a_100011217769_100000211032 [0,0,0,0,0,2|2,0,0]=4 2347 B15R2.2195 C(=CC1CCCCC1)c2ncccn2 271570a_100016283615_100000211032 [0,0,0,0,0,2|2,0,0]=4 2348 B15R2.2195 c1ccc(nc1)CCN2CCOCC2 2230a_100015191051_100015183660 [0,0,0,0,0,2|2,0,0]=4 2349 B15R2.2195 c1ccc(nc1)CCN2CCOCC2 269982a_100015191051_100015183660 [0,0,0,0,0,2|2,0,0]=4 2350 B15R2.2195 c1ccc(nc1)CCN2CCSCC2 2230a_100000737611_100015183660 [0,0,0,0,0,2|2,0,0]=4 2351 B15R2.2195 c1ccc(nc1)CCN2CCSCC2 269982a_100000737611_100015183660 [0,0,0,0,0,2|2,0,0]=4 2352 B15R2.2195 c1ccc(nc1)CNC2CCNCC2 270004a_100000210449_100015192401 [0,0,0,0,0,2|2,0,0]=4 2353 B15R2.2195 c1cnc(nc1)CNC2CCCCC2 2230a_100000182618_100000703007 [0,0,0,0,0,2|2,0,0]=4 2354 B15R2.2195 c1cnc(nc1)CNC2CCCCC2 270004a_100000182618_100011532527 [0,0,0,0,0,2|2,0,0]=4 2355 B15R2.2195 c1cnc(nc1)CNC2CCCCC2 34a_100000182618_100000703007 [0,0,0,0,0,2|2,0,0]=4 2356 B15R2.2195 c1cnc(nc1)CNC2CCOCC2 2230a_100000741149_100000703007 [0,0,0,0,0,2|2,0,0]=4 2357 B15R2.2195 c1cnc(nc1)CNC2CCOCC2 270004a_100000741149_100011532527 [0,0,0,0,0,2|2,0,0]=4 2358 B15R2.2195 c1cnc(nc1)CNC2CCOCC2 34a_100000741149_100000703007 [0,0,0,0,0,2|2,0,0]=4 2359 B15R2.2195 c1cnc(nc1)CNC2CCSCC2 2230a_100000748639_100000703007 [0,0,0,0,0,2|2,0,0]=4 2360 B15R2.2195 c1cnc(nc1)CNC2CCSCC2 270004a_100000748639_100011532527 [0,0,0,0,0,2|2,0,0]=4 2361 B15R2.2195 c1cnc(nc1)CNC2CCSCC2 34a_100000748639_100000703007 [0,0,0,0,0,2|2,0,0]=4 2362 B15R2.2195 c1cnc(nc1)COC2CCCCC2 34a_100000210231_100000703007 [0,0,0,0,0,2|2,0,0]=4 2363 B15R2.2195 c1cnc(nc1)COC2CCCCC2 7a_100000210231_100000703007 [0,0,0,0,0,2|2,0,0]=4 2364 B15R2.2195 c1cnc(nc1)COC2CCOCC2 34a_100000744328_100000703007 [0,0,0,0,0,2|2,0,0]=4 2365 B15R2.2195 c1cnc(nc1)COC2CCSCC2 34a_100000731022_100000703007 [0,0,0,0,0,2|2,0,0]=4 2366 B15R2.2195 c1cnc(nc1)COC2CCSCC2 7a_100000731022_100000703007 [0,0,0,0,0,2|2,0,0]=4 2367 B15R2.2195 c1cnc(nc1)CSC2CCCCC2 62a_100000210327_100000703007 [0,0,0,0,0,2|2,0,0]=4 2368 B15R2.2195 c1cnc(nc1)CSC2CCCCC2 62a_100000703007_100000210327 [0,0,0,0,0,2|2,0,0]=4 2369 B15R2.2195 c1cnc(nc1)CSC2CCOCC2 62a_100000703007_100011324220 [0,0,0,0,0,2|2,0,0]=4 2370 B15R2.2195 c1cnc(nc1)CSC2CCSCC2 62a_100000703007_100000069128 [0,0,0,0,0,2|2,0,0]=4 2371 B15R2.2195 c1cnc(nc1)NCC2CCCCC2 27a_100000210473_100000211032 [0,0,0,0,0,2|2,0,0]=4 2372 B15R2.2195 c1cnc(nc1)NCC2CCOCC2 27a_100000746373_100000211032 [0,0,0,0,0,2|2,0,0]=4 2373 B15R2.2195 c1cnc(nc1)NCC2CCSCC2 27a_100015188806_100000211032 [0,0,0,0,0,2|2,0,0]=4 2374 B15R2.2195 c1cnc(nc1)NN=C2CCCCC2 4a_100000736892_100000210434 [0,0,0,0,0,2|2,0,0]=4 2375 B15R2.2195 c1cnc(nc1)NN=C2CCOCC2 4a_100000736892_100011217826 [0,0,0,0,0,2|2,0,0]=4 2376 B15R2.2195 c1cnc(nc1)NN=C2CCSCC2 4a_100000736892_100000203788 [0,0,0,0,0,2|2,0,0]=4 2377 B15R2.2195 c1cnc(nc1)SCC2CCCCC2 62a_100000211032_100000211423 [0,0,0,0,0,2|2,0,0]=4 2378 B15R2.2195 c1cnc(nc1)SCC2CCCCC2 62a_100000211423_100000211032 [0,0,0,0,0,2|2,0,0]=4 2379 B15R2.2195 c1cnc(nc1)SCC2CCOCC2 62a_100000211032_100000749018 [0,0,0,0,0,2|2,0,0]=4 2380 B15R2.2195 c1cnc(nc1)SCC2CCOCC2 62a_100000754603_100000211032 [0,0,0,0,0,2|2,0,0]=4 2381 B15R2.2169 c1cnc(nc1)N2CCCCCCC2 27a_100000211400_100000211032 [0,0,0,0,0,2|1,0,0]=3