0 B15R1.1035 CCCCC\C(=C\c1ccccc1)CO Amb22002472 [0,0,0,0,0,0|0,0,2]=2 1 B15R1.1035 CCCCC\C(C=O)=C\c1ccccc1 Amb8493476 [0,0,0,0,0,0|0,0,0]=0 2 B14R1.158 CCCCNC(=O)Nc1ccccc1 Amb6565930 [1,0,0,0,0,0|2,0,0]=3 3 B14R1.158 CCCCNC(=O)Nc1ccccn1 Amb575148 [1,0,0,0,0,0|3,0,0]=4 4 B14R1.158 CCCCNC(=S)Nc1ccccc1 Amb1804766 [1,0,0,0,0,0|2,1,0]=4 5 B14R1.158 CCCCOC(=O)Cc1ccccc1 Amb9787240 [1,0,0,0,0,0|1,0,1]=3 6 B14R1.158 CCCCOC(=O)Cc1ccccn1 Amb32664954 [1,0,0,0,0,0|2,0,1]=4 7 B14R1.158 CCCNC\C(C)=C\c1ccccc1 Amb19890261 [1,0,0,0,0,0|1,0,1]=3 8 B14R1.158 CCCNC\C(C)=C\c1ccccc1 Amb20673527 [1,0,0,0,0,0|1,0,1]=3 9 B14R1.158 CCCONC(=O)Nc1ccccc1 Amb2818934 [1,0,0,0,0,0|3,0,0]=4 10 B14R1.158 CCCSCC(=O)Cc1ccccc1 Amb9668687 [1,0,0,0,0,0|1,0,1]=3 11 B14R1.158 CCOCNC(=O)Nc1ccccc1 Amb4433479 [1,0,0,0,0,0|3,0,0]=4 12 B14R1.158 CCSCNC(=O)Nc1ccccc1 Amb27957766 [1,0,0,0,0,0|3,0,0]=4 13 B14R1.158 CC\C=C/CC(=O)Nc1ccccc1 Amb27754026 [1,0,0,0,0,0|1,0,2]=4 14 B14R1.158 CC\C=C\CC(=O)Nc1ccccc1 Amb27423080 [1,0,0,0,0,0|1,0,2]=4 15 B14R1.158 CNCCCC(=O)Nc1ccccc1 Amb28600467 [1,0,0,0,0,0|2,0,0]=3 16 B14R1.158 CSCCNC(=O)Nc1ccccc1 Amb25678581 [1,0,0,0,0,0|3,0,0]=4 17 B14R1.158 NCCCNC(=O)Cc1ccccc1 Amb6280127 [1,0,0,0,0,0|2,0,1]=4 18 B14R1.158 NCCCNC(=O)Nc1ccccc1 Amb10808642 [1,0,0,0,0,0|3,0,0]=4 19 B14R1.158 NCCCNC(=O)Nc1ccccc1 Amb18330404 [1,0,0,0,0,0|3,0,0]=4 20 B14R1.158 O=C(CCCCBr)Nc1ccccc1 Amb17264932 [1,0,0,0,0,0|2,0,0]=3 21 B14R1.158 O=C(CNCCO)Nc1ccccc1 Amb9243152 [1,0,0,0,0,0|3,0,0]=4 22 B14R1.158 O=C(CSCCBr)Nc1ccccc1 Amb17110748 [1,0,0,0,0,0|3,0,0]=4 23 B14R1.158 O=C(CSCCO)Cc1ccccc1 Amb9668403 [1,0,0,0,0,0|2,0,1]=4 24 B14R1.158 O=C(CSCCO)Nc1ccccc1 Amb3568977 [1,0,0,0,0,0|3,0,0]=4 25 B14R1.467 O=C\C(C#CCO)=C/c1ccccc1 Amb28141272 [1,0,0,0,0,0|1,0,2]=4 26 B16R1.1407 CCCCCC\C(C=O)=C/c1ccccc1 Amb533085 [0,1,0,0,0,0|0,0,0]=1 27 B16R1.1407 CCCCCC\C(C=O)=C\c1ccccc1 Amb574394 [0,1,0,0,0,0|0,0,0]=1 28 B16R2.35 CC1NCCN(Cc2ccccc2)C1=O Amb2699332 [0,0,0,1,0,0|2,0,1]=4 29 B16R2.35 CC1NCCN(Cc2ccccc2)C1=O Amb8503346 [0,0,0,1,0,0|2,0,1]=4 30 B16R2.35 C[C@@H]1NCCN(Cc2ccccc2)C1=O Amb27767096 [0,0,0,1,0,0|2,0,1]=4 31 B16R2.35 NC1CCCN(Cc2ccccc2)C1=O Amb22059514 [0,0,0,1,0,0|2,0,1]=4 32 B16R2.35 N[C@H]1CCCN(Cc2ccccc2)C1=O Amb27850600 [0,0,0,1,0,0|2,0,1]=4 33 B16R2.35 O=C1C(Br)CCCN1Cc2ccccc2 Amb22059511 [0,0,0,1,0,0|2,0,1]=4 34 B16R2.35 O=C1C(I)CCCN1Cc2ccccc2 Amb22227861 [0,0,0,1,0,0|2,0,1]=4 35 B16R2.35 O=C1C(O)CCCN1Cc2ccccc2 Amb22227864 [0,0,0,1,0,0|2,0,1]=4 36 B16R2.69 O=C1CCCCCC1Cc2ccccc2 Amb27471390 [0,0,0,1,0,0|0,0,2]=3 37 B16R2.69 O=C1CCCCCC1Cc2ccccn2 Amb27798180 [0,0,0,1,0,0|1,0,2]=4 38 B16R2.69 O=C1CCCCCC1Cc2ccncc2 Amb27488101 [0,0,0,1,0,0|1,0,2]=4 39 B16R2.69 O=C1CCCCCN1Cc2ccccc2 Amb2416116 [0,0,0,1,0,0|1,0,1]=3 40 B16R2.69 O=C1CCNCCN1Cc2ccccc2 Amb18567021 [0,0,0,1,0,0|2,0,1]=4 41 B16R2.69 O=C1CNCCCN1Cc2ccccc2 Amb18567022 [0,0,0,1,0,0|2,0,1]=4 42 B16R2.69 O=C1COCCCN1Cc2ccccc2 Amb16186654 [0,0,0,1,0,0|2,0,1]=4 43 B16R2.112 CCCCn1c(C=O)cc2ccccc21 Amb32417760 [0,0,0,1,0,0|1,0,0]=2 44 B16R2.112 CCCCn1c(C=O)nc2ccccc21 Amb1099027 [0,0,0,1,0,0|2,0,0]=3 45 B16R2.112 COCCn1c(C=O)cc2ccccc21 Amb32418364 [0,0,0,1,0,0|2,0,0]=3 46 B16R2.112 COCCn1c(C=O)nc2ccccc21 Amb16233496 [0,0,0,1,0,0|3,0,0]=4 47 B16R2.2272 Cc1c(CCCCN)oc2ccccc12 Amb18554087 [0,0,0,1,0,0|3,0,0]=4 48 B16R2.2272 Cn1c(CCCCN)cc2ccccc21 Amb18786374 [0,0,0,1,0,0|3,0,0]=4 49 B16R2.2441 BrCCCOc1ccc2ccccc2c1 Amb2231590 [0,0,0,1,0,0|3,0,0]=4 50 B16R2.2441 CCCCOc1ccc2ccccc2c1 Amb3836169 [0,0,0,1,0,0|2,0,0]=3 51 B16R2.2441 CCCCOc1ccc2ncccc2c1 Amb19108435 [0,0,0,1,0,0|3,0,0]=4 52 B16R2.2441 CCCNCc1ccc2ccccc2c1 Amb6665841 [0,0,0,1,0,0|2,0,0]=3 53 B16R2.2441 CNCCOc1ccc2ccccc2c1 Amb7761798 [0,0,0,1,0,0|3,0,0]=4 54 B16R2.2441 ClCCCOc1ccc2ccccc2c1 Amb6662694 [0,0,0,1,0,0|3,0,0]=4 55 B16R2.2441 NCCCCc1ccc2ccccc2c1 Amb18049792 [0,0,0,1,0,0|2,0,0]=3 56 B16R2.2441 NCCCCc1ccc2ccccc2n1 Amb33380484 [0,0,0,1,0,0|3,0,0]=4 57 B16R2.2441 NCCCCc1ccc2cccnc2c1 Amb18353898 [0,0,0,1,0,0|3,0,0]=4 58 B16R2.2441 NCCCCc1ccc2ccncc2c1 Amb19105808 [0,0,0,1,0,0|3,0,0]=4 59 B16R2.2441 NCCCCc1ccc2cnccc2c1 Amb18353872 [0,0,0,1,0,0|3,0,0]=4 60 B16R2.2441 NCCCCc1ccc2ncccc2c1 Amb18353926 [0,0,0,1,0,0|3,0,0]=4 61 B16R2.2441 NCCCCc1cnc2ccccc2c1 Amb33474974 [0,0,0,1,0,0|2,0,0]=3 62 B16R2.2441 NCCCCc1cnc2ccccc2n1 Amb33358837 [0,0,0,1,0,0|3,0,0]=4 63 B16R2.2441 NCCCOc1ccc2ccccc2c1 Amb1135799 [0,0,0,1,0,0|3,0,0]=4 64 B16R2.2441 NCCCOc1cnc2ccccc2c1 Amb33171990 [0,0,0,1,0,0|3,0,0]=4 65 B16R2.2441 O=CCCCc1ccc2ccccc2c1 Amb18549395 [0,0,0,1,0,0|2,0,1]=4 66 B16R2.2441 O=CCCCc1cnc2ccccc2c1 Amb33172349 [0,0,0,1,0,0|2,0,1]=4 67 B16R2.2441 OCCCCc1ccc2ccccc2c1 Amb33716158 [0,0,0,1,0,0|2,0,0]=3 68 B16R2.2441 OCCCOc1ccc2ccccc2c1 Amb9370699 [0,0,0,1,0,0|3,0,0]=4 69 B16R2.2441 OCCNCc1ccc2ccccc2c1 Amb7757056 [0,0,0,1,0,0|3,0,0]=4 70 B16R2.2441 OCCNCc1cnc2ccccc2c1 Amb19649748 [0,0,0,1,0,0|3,0,0]=4 71 B16R2.2441 SCCCOc1ccc2ccccc2c1 Amb17243345 [0,0,0,1,0,0|3,0,0]=4 72 B16R2.7942 O=CC1(Cc2ccccc2)CCCOC1 Amb28342528 [0,0,0,1,0,0|1,0,2]=4 73 B16R2.7942 O=CC1(Oc2ccccc2)CCCCC1 Amb30017109 [0,0,0,1,0,0|1,0,1]=3 74 B16R2.7942 O=CC1(Oc2ccccc2)CCOCC1 Amb35723990 [0,0,0,1,0,0|2,0,1]=4 75 B16R2.11144 CNC1CCN(Cc2ccccc2)C1=O Amb18292567 [0,0,0,1,0,0|2,0,1]=4 76 B16R2.11144 COC1CCN(Cc2ccccc2)C1=O Amb28369002 [0,0,0,1,0,0|2,0,1]=4 77 B16R2.11171 CCn1ncc(C=O)c1-c2ccccc2 Amb19039012 [0,0,0,1,0,0|2,0,1]=4 78 B16R2.11171 CCn1nnc(C=O)c1-c2ccccc2 Amb17537289 [0,0,0,1,0,0|3,0,0]=4 79 B16R2.47238 CC1CCCC1(C=O)Cc2ccccn2 Amb27491531 [0,0,0,1,0,0|1,0,2]=4 80 B16R2.51757 CCCc1nc(C=O)cc2ccccc12 Amb31096519 [0,0,0,1,0,0|1,0,1]=3 81 B16R1.1758 C=CC(CCCCC)NCc1ccccc1 Amb27751280 [0,0,0,0,0,1|1,0,2]=4 82 B13R1.28 BrCCOC\C=C\c1ccccc1 Amb24113552 [2,0,0,0,0,0|2,0,0]=4 83 B13R1.28 CCCCCC#Cc1ccccc1 Amb2721606 [2,0,0,0,0,0|0,0,2]=4 84 B13R1.28 CCCCCCCc1ccccc1 Amb8513456 [2,0,0,0,0,0|0,0,2]=4 85 B13R1.28 CCCCCCNc1ccccc1 Amb597405 [2,0,0,0,0,0|1,0,1]=4 86 B13R1.28 CCCCCNCc1ccccc1 Amb838091 [2,0,0,0,0,0|1,0,1]=4 87 B13R1.28 CCCCC\C=C\c1cccnc1 Amb2613049 [2,0,0,0,0,0|1,0,0]=3 88 B13R1.28 CCCNC\C=C\c1ccccc1 Amb20673523 [2,0,0,0,0,0|1,0,0]=3 89 B13R1.28 CCCNC\C=C\c1ccccc1 Amb838094 [2,0,0,0,0,0|1,0,0]=3 90 B13R1.28 CCNCC\C=C/c1ccccc1 Amb17142949 [2,0,0,0,0,0|1,0,0]=3 91 B13R1.28 COCCC\N=C\c1ccccc1 Amb33280239 [2,0,0,0,0,0|2,0,0]=4 92 B13R1.28 NCCSC\C=C\c1ccccc1 Amb9727179 [2,0,0,0,0,0|2,0,0]=4 93 B13R1.28 OCCNC\C=C\c1ccccc1 Amb1926880 [2,0,0,0,0,0|2,0,0]=4 94 B13R1.28 OCCNC\C=C\c1ccccc1 Amb6864512 [2,0,0,0,0,0|2,0,0]=4 95 B13R1.44 CCCCC(=O)Cc1ccccc1 Amb3940684 [2,0,0,0,0,0|0,0,1]=3 96 B13R1.44 CCCCC(=O)Nc1ccccc1 Amb3104073 [2,0,0,0,0,0|1,0,0]=3 97 B13R1.44 CCCCC(=O)Nc1ccccn1 Amb2674630 [2,0,0,0,0,0|2,0,0]=4 98 B13R1.44 CCCCC(=O)Nc1ccncc1 Amb5797736 [2,0,0,0,0,0|2,0,0]=4 99 B13R1.44 CCCCC(=O)Oc1ccccc1 Amb3123544 [2,0,0,0,0,0|1,0,0]=3 100 B13R1.44 CCCNC(=O)Nc1ccccc1 Amb1233730 [2,0,0,0,0,0|2,0,0]=4 101 B13R1.44 CCCOC(=O)Cc1ccccc1 Amb9242897 [2,0,0,0,0,0|1,0,1]=4 102 B13R1.44 CCCOC(=O)Nc1ccccc1 Amb3101936 [2,0,0,0,0,0|2,0,0]=4 103 B13R1.44 CCCSC(=O)Nc1ccccc1 Amb4018339 [2,0,0,0,0,0|2,0,0]=4 104 B13R1.44 CCNCC(=O)Nc1ccccc1 Amb28600287 [2,0,0,0,0,0|2,0,0]=4 105 B13R1.44 CCNCC(=O)Nc1ccccc1 Amb6242927 [2,0,0,0,0,0|2,0,0]=4 106 B13R1.44 CCOCC(=O)Nc1ccccc1 Amb2662084 [2,0,0,0,0,0|2,0,0]=4 107 B13R1.44 CCSCC(=O)Cc1ccccc1 Amb9668576 [2,0,0,0,0,0|1,0,1]=4 108 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb15740952 [2,0,0,0,0,0|2,0,0]=4 109 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb9833670 [2,0,0,0,0,0|2,0,0]=4 110 B13R1.44 CNCC\C(C)=C\c1ccccc1 Amb33476406 [2,0,0,0,0,0|1,0,1]=4 111 B13R1.44 CSCCC(=O)Nc1ccccc1 Amb27260793 [2,0,0,0,0,0|2,0,0]=4 112 B13R1.44 C\C(=C/c1ccccc1)CCCBr Amb33381474 [2,0,0,0,0,0|1,0,1]=4 113 B13R1.44 C\C(=C/c1ccccc1)CCCN Amb32951765 [2,0,0,0,0,0|1,0,1]=4 114 B13R1.44 C\C(=C/c1ccccc1)CCCO Amb33081745 [2,0,0,0,0,0|1,0,1]=4 115 B13R1.44 C\C(=C/c1ccccc1)CCCS Amb33381252 [2,0,0,0,0,0|1,0,1]=4 116 B13R1.44 NCCCC(=O)Nc1ccccc1 Amb13952779 [2,0,0,0,0,0|2,0,0]=4 117 B13R1.44 NCCCC(=O)Nc1ccccc1 Amb5785178 [2,0,0,0,0,0|2,0,0]=4 118 B13R1.44 O=C(CCCCl)Nc1ccccc1 Amb1125144 [2,0,0,0,0,0|2,0,0]=4 119 B13R1.44 O=C(CCCO)Nc1ccccc1 Amb17233533 [2,0,0,0,0,0|2,0,0]=4 120 B13R1.79 CCO\C(C=O)=C/c1ccccc1 Amb22546895 [2,0,0,0,0,0|1,0,0]=3 121 B15R1.83 CCCCCOC(=O)Cc1ccccc1 Amb4005871 [1,1,0,0,0,0|0,0,1]=3 122 B15R1.83 CCCCNC\C(C)=C\c1ccccc1 Amb20673564 [1,1,0,0,0,0|0,0,1]=3 123 B15R1.83 CCCCNC\C(C)=C\c1ccccc1 Amb20673566 [1,1,0,0,0,0|0,0,1]=3 124 B15R1.83 CCCCOCC(=O)Nc1ccccc1 Amb22229721 [1,1,0,0,0,0|1,0,0]=3 125 B15R1.83 CCCCSCC(=O)Cc1ccccc1 Amb9667969 [1,1,0,0,0,0|0,0,1]=3 126 B15R1.83 CCCNCCC(=O)Nc1ccccc1 Amb24116205 [1,1,0,0,0,0|1,0,0]=3 127 B15R1.83 COCCCNC(=O)Nc1ccccc1 Amb8549956 [1,1,0,0,0,0|2,0,0]=4 128 B15R1.83 COCCNCC(=O)Nc1ccccc1 Amb6707146 [1,1,0,0,0,0|2,0,0]=4 129 B15R1.83 COCCSCC(=O)Cc1ccccc1 Amb9668225 [1,1,0,0,0,0|1,0,1]=4 130 B15R1.83 CSCCSCC(=O)Cc1ccccc1 Amb32682611 [1,1,0,0,0,0|1,0,1]=4 131 B15R1.83 NCCCCCC(=O)Nc1ccccc1 Amb33299275 [1,1,0,0,0,0|1,0,0]=3 132 B15R1.83 NCCCCCC(=O)Nc1ccccc1 Amb6280040 [1,1,0,0,0,0|1,0,0]=3 133 B15R1.83 NCCCCCC(=O)Nc1ccncc1 Amb21885642 [1,1,0,0,0,0|2,0,0]=4 134 B15R1.83 NCCCSCC(=O)Nc1ccccc1 Amb17041414 [1,1,0,0,0,0|2,0,0]=4 135 B15R1.83 O=C(CSCCCO)Cc1ccccc1 Amb32683176 [1,1,0,0,0,0|1,0,1]=4 136 B15R1.83 O=C(CSCCCO)Nc1ccccc1 Amb17502753 [1,1,0,0,0,0|2,0,0]=4 137 B15R1.93 CCCCNC(=O)C(Cl)c1ccccc1 Amb8824964 [1,1,0,0,0,0|1,0,1]=4 138 B15R1.93 CNCCCC(=O)N(C)c1ccccc1 Amb26084864 [1,1,0,0,0,0|2,0,0]=4 139 B15R1.128 CCCCCC(=O)Nc1ccc(N)cc1 Amb843237 [1,1,0,0,0,0|1,0,0]=3 140 B15R1.128 CCCCNC(=O)Cc1ccc(N)cc1 Amb6247768 [1,1,0,0,0,0|1,0,1]=4 141 B15R1.128 CCCCNC(=O)Nc1ccc(I)cc1 Amb11224135 [1,1,0,0,0,0|2,0,0]=4 142 B15R1.128 CCCCOC(=O)Cc1ccc(N)cc1 Amb8426803 [1,1,0,0,0,0|1,0,1]=4 143 B15R1.128 CCCNCC(=O)Nc1ccc(Cl)cc1 Amb6714464 [1,1,0,0,0,0|2,0,0]=4 144 B15R1.128 CCCSCC(=O)Cc1ccc(F)cc1 Amb9668693 [1,1,0,0,0,0|1,0,1]=4 145 B15R1.128 O=C(CCCCCl)Nc1ccc(O)cc1 Amb4393013 [1,1,0,0,0,0|2,0,0]=4 146 B15R1.129 CCCCCC(=O)Nc1cccc(N)c1 Amb843231 [1,1,0,0,0,0|1,0,0]=3 147 B15R1.129 CCCCCC(=O)Oc1cccc(C)c1 Amb9787396 [1,1,0,0,0,0|1,0,0]=3 148 B15R1.129 CCCCNC(=O)Cc1cccc(N)c1 Amb8426832 [1,1,0,0,0,0|1,0,1]=4 149 B15R1.129 CCCCOC(=O)Cc1cccc(N)c1 Amb8426817 [1,1,0,0,0,0|1,0,1]=4 150 B15R1.129 O=C(CCCCCl)Nc1cccc(O)c1 Amb22261595 [1,1,0,0,0,0|2,0,0]=4 151 B15R1.551 CCCNC(C)C(=O)Nc1ccccc1 Amb7754423 [1,1,0,0,0,0|2,0,0]=4 152 B15R1.964 CCC(C)NC\C(C)=C\c1ccccc1 Amb19891306 [1,1,0,0,0,0|1,0,1]=4 153 B15R1.964 CCC(C)NC\C(C)=C\c1ccccc1 Amb20673630 [1,1,0,0,0,0|1,0,1]=4 154 B15R1.964 CCC(C)SCC(=O)Cc1ccccc1 Amb9668590 [1,1,0,0,0,0|1,0,1]=4 155 B15R1.1081 CC(C)CSCC(=O)Cc1ccccc1 Amb9667983 [1,1,0,0,0,0|1,0,1]=4 156 B15R1.1081 C\C(=C/c1ccccc1)CNCC(C)C Amb20673696 [1,1,0,0,0,0|1,0,1]=4 157 B15R1.1081 C\C(=C/c1ccccc1)CNCC(C)C Amb20673697 [1,1,0,0,0,0|1,0,1]=4 158 B15R1.1409 CCCCNC(=O)Nc1ccccc1Br Amb6747946 [1,1,0,0,0,0|2,0,0]=4 159 B15R1.1409 CCCNCC(=O)Nc1ccccc1C Amb1105907 [1,1,0,0,0,0|2,0,0]=4 160 B15R1.1409 CCCNCC(=O)Nc1ccccc1C Amb33334636 [1,1,0,0,0,0|2,0,0]=4 161 B15R1.1409 CCCSCC(=O)Cc1ccccc1F Amb9668692 [1,1,0,0,0,0|1,0,1]=4 162 B15R1.3922 CCCCN(Cc1ccccc1)C(N)=O Amb26618712 [1,1,0,0,0,0|1,0,1]=4 163 B15R1.3922 CCCC[C@@H](Nc1ccccc1)C(=O)O Amb32708671 [1,1,0,0,0,0|1,0,1]=4 164 B15R1.3474 CCCCNC(C(=O)O)c1ccccc1 Amb24065451 [0,1,0,0,1,0|1,0,1]=4 165 B15R1.3474 CCCCOC(C(=O)O)c1ccccc1 Amb8894955 [0,1,0,0,1,0|1,0,1]=4 166 B17R1.25051 CCCCCC(NCc1ccccc1)C(=O)O Amb27251312 [0,1,0,0,0,1|0,0,2]=4 167 B17R1.1923 CCCCCN(Cc1ccc(Cl)cc1)C(=O)Cl Amb32863753 [0,2,0,0,0,0|1,0,1]=4 168 B15R2.31 CC1CNC\C(=C\c2ccccc2)C1 Amb35709878 [1,0,0,1,0,0|1,0,1]=4 169 B15R2.31 CC1C\C(=C\c2ccccc2)CCN1 Amb35734546 [1,0,0,1,0,0|1,0,1]=4 170 B15R2.31 NC1CCC\C(=C\c2ccccc2)C1 Amb27830479 [1,0,0,1,0,0|1,0,1]=4 171 B15R2.54 O=C1CCCCCC1c2ccccc2 Amb6357095 [1,0,0,1,0,0|0,0,1]=3 172 B15R2.54 O=C1CCCCCN1c2ccccn2 Amb4010728 [1,0,0,1,0,0|2,0,0]=4 173 B15R2.54 O=C1CCNCCN1c2ccccc2 Amb18564771 [1,0,0,1,0,0|2,0,0]=4 174 B15R2.54 O=C1CCOCCC1c2ccccc2 Amb28192214 [1,0,0,1,0,0|1,0,1]=4 175 B15R2.54 O=C1CNCCCN1c2ccccc2 Amb18564772 [1,0,0,1,0,0|2,0,0]=4 176 B15R2.54 O=C1NCCCCC1c2ccccc2 Amb24056374 [1,0,0,1,0,0|1,0,1]=4 177 B15R2.64 C\C(=C/c1ccccc1)C2CCCN2 Amb33381146 [1,0,0,1,0,0|1,0,1]=4 178 B15R2.64 C\C(=C/c1ccccc1)C2CCNC2 Amb32951242 [1,0,0,1,0,0|1,0,1]=4 179 B15R2.64 C\C(=C\c1ccccc1)C2CCCN2 Amb27653716 [1,0,0,1,0,0|1,0,1]=4 180 B15R2.64 N=C(Nc1ccccc1)C2CCCC2 Amb28198368 [1,0,0,1,0,0|2,0,0]=4 181 B15R2.64 O=C(Cc1ccccc1)C2CCCC2 Amb17139197 [1,0,0,1,0,0|0,0,1]=3 182 B15R2.64 O=C(Cc1ccccc1)C2CCCN2 Amb17234683 [1,0,0,1,0,0|1,0,1]=4 183 B15R2.64 O=C(Cc1ccccc1)C2CCCO2 Amb19060917 [1,0,0,1,0,0|1,0,1]=4 184 B15R2.64 O=C(Cc1ccccc1)[C@@H]2CCCN2 Amb29891604 [1,0,0,1,0,0|1,0,1]=4 185 B15R2.64 O=C(Cc1ccccc1)[C@@H]2CCNC2 Amb30039339 [1,0,0,1,0,0|1,0,1]=4 186 B15R2.64 O=C(Cc1ccccc1)[C@H]2CCCN2 Amb35662245 [1,0,0,1,0,0|1,0,1]=4 187 B15R2.64 O=C(Cc1ccccc1)[C@H]2CCNC2 Amb35660012 [1,0,0,1,0,0|1,0,1]=4 188 B15R2.64 O=C(Cc1cccnc1)C2CCCC2 Amb18330141 [1,0,0,1,0,0|1,0,1]=4 189 B15R2.64 O=C(Cc1ccncc1)C2CCCC2 Amb18330142 [1,0,0,1,0,0|1,0,1]=4 190 B15R2.64 O=C(Nc1ccccc1)C2CCCC2 Amb2674518 [1,0,0,1,0,0|1,0,0]=3 191 B15R2.64 O=C(Nc1ccccc1)C2CCCN2 Amb2694148 [1,0,0,1,0,0|2,0,0]=4 192 B15R2.64 O=C(Nc1ccccc1)C2CCCN2 Amb6892405 [1,0,0,1,0,0|2,0,0]=4 193 B15R2.64 O=C(Nc1ccccc1)C2CCCO2 Amb6535805 [1,0,0,1,0,0|2,0,0]=4 194 B15R2.64 O=C(Nc1ccccc1)C2CCCS2 Amb27458287 [1,0,0,1,0,0|2,0,0]=4 195 B15R2.64 O=C(Nc1ccccc1)N2CCCC2 Amb1680298 [1,0,0,1,0,0|2,0,0]=4 196 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCN2 Amb2694159 [1,0,0,1,0,0|2,0,0]=4 197 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCN2 Amb33456280 [1,0,0,1,0,0|2,0,0]=4 198 B15R2.64 O=C(Nc1ccccc1)[C@@H]2CCCO2 Amb27247113 [1,0,0,1,0,0|2,0,0]=4 199 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCCN2 Amb26848588 [1,0,0,1,0,0|2,0,0]=4 200 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCCN2 Amb31176115 [1,0,0,1,0,0|2,0,0]=4 201 B15R2.64 O=C(Nc1ccccc1)[C@H]2CCNC2 Amb30009722 [1,0,0,1,0,0|2,0,0]=4 202 B15R2.64 O=C(Nc1ccccn1)C2CCCC2 Amb6530535 [1,0,0,1,0,0|2,0,0]=4 203 B15R2.64 O=C(Oc1ccccc1)C2CCCN2 Amb17336316 [1,0,0,1,0,0|2,0,0]=4 204 B15R2.64 O=C(Oc1ccccc1)C2CCCO2 Amb25121755 [1,0,0,1,0,0|2,0,0]=4 205 B15R2.64 O=C(Oc1ccccc1)N2CCCC2 Amb2732298 [1,0,0,1,0,0|2,0,0]=4 206 B15R2.64 O=C(Sc1ccccc1)C2CCCN2 Amb27469765 [1,0,0,1,0,0|2,0,0]=4 207 B15R2.64 S=C(Nc1ccccc1)C2CCCC2 Amb27751373 [1,0,0,1,0,0|1,1,0]=4 208 B15R2.541 CC1CNCC(=O)N1c2ccccc2 Amb26472424 [1,0,0,1,0,0|2,0,0]=4 209 B15R2.1122 CC1CCC1C(=O)Nc2ccccc2 Amb27439068 [1,0,0,1,0,0|1,0,0]=3 210 B15R2.1122 CC1CCN1C(=O)Nc2ccccc2 Amb24678783 [1,0,0,1,0,0|2,0,0]=4 211 B15R2.1256 O=C(NCC1CC1)Nc2ccccc2 Amb2744959 [1,0,0,1,0,0|2,0,0]=4 212 B15R2.1256 O=C(NCC1CC1)Oc2ccccc2 Amb24271481 [1,0,0,1,0,0|2,0,0]=4 213 B15R2.1256 O=C(Nc1ccccc1)OCC2CC2 Amb22480486 [1,0,0,1,0,0|2,0,0]=4 214 B15R2.1435 CCCCN1C(=O)Cc2ccccc21 Amb2720641 [1,0,0,1,0,0|1,0,1]=4 215 B15R2.1435 CCCCN1C(=O)Nc2ccccc21 Amb18537190 [1,0,0,1,0,0|2,0,0]=4 216 B15R2.1435 CCCCn1c(C)cc2ccccc21 Amb8390326 [1,0,0,1,0,0|1,0,1]=4 217 B15R2.1435 CCCOC1C(=O)Nc2ccccc21 Amb27653342 [1,0,0,1,0,0|2,0,0]=4 218 B15R2.1435 CNCCC1C(=O)Nc2ccccc21 Amb26576106 [1,0,0,1,0,0|2,0,0]=4 219 B15R2.1435 O=C1Nc2ccccc2C1CCCO Amb6316201 [1,0,0,1,0,0|2,0,0]=4 220 B15R2.1690 CC[C@@H]1O[C@@H]1C(=O)Nc2ccccc2 Amb27646572 [1,0,0,1,0,0|2,0,0]=4 221 B15R2.1690 CC[C@H]1O[C@H]1C(=O)Nc2ccccc2 Amb27441067 [1,0,0,1,0,0|2,0,0]=4 222 B15R2.1690 COC1CC1C(=O)Nc2ccccc2 Amb35671228 [1,0,0,1,0,0|2,0,0]=4 223 B15R2.1690 C\C(=C/c1ccccc1)C2CC2CN Amb33381201 [1,0,0,1,0,0|1,0,1]=4 224 B15R2.1690 C\C(=C/c1ccccc1)[C@@H]2C[C@H]2CN Amb33381198 [1,0,0,1,0,0|1,0,1]=4 225 B15R2.1690 C\C(=C\c1ccccc1)C2CC2CO Amb28063822 [1,0,0,1,0,0|1,0,1]=4 226 B15R2.1690 O=C(Nc1ccccc1)C2CC2CO Amb28183715 [1,0,0,1,0,0|2,0,0]=4 227 B15R2.2167 C(=C1/CCCNCC1)/c2ccccc2 Amb27189481 [1,0,0,1,0,0|1,0,1]=4 228 B15R2.2167 C(=C1CCCCCC1)c2ccccc2 Amb10606580 [1,0,0,1,0,0|0,0,1]=3 229 B15R2.2167 c1ccc(NC2=NCCCCC2)cc1 Amb22549304 [1,0,0,1,0,0|2,0,0]=4 230 B15R2.2167 c1ccc(NC2=NCCCCC2)cc1 Amb3466931 [1,0,0,1,0,0|2,0,0]=4 231 B15R2.2167 c1ccc(\N=C2/CCCCCN2)cc1 Amb3993791 [1,0,0,1,0,0|2,0,0]=4 232 B15R2.2203 CCCNCc1cc2ccccc2o1 Amb6719091 [1,0,0,1,0,0|1,0,1]=4 233 B15R2.2203 CCNCCc1cc2ccccc2s1 Amb19649532 [1,0,0,1,0,0|1,1,0]=4 234 B15R2.2203 NCCCCc1cc2ccccc2o1 Amb18820049 [1,0,0,1,0,0|1,0,1]=4 235 B15R2.2203 NCCCCc1cc2ccccc2s1 Amb18782051 [1,0,0,1,0,0|1,1,0]=4 236 B15R2.2216 CCOC1CC(=O)C1c2ccccc2 Amb27798155 [1,0,0,1,0,0|1,0,1]=4 237 B15R2.2280 O=C1CCC(CO)N1c2ccccc2 Amb27665553 [1,0,0,1,0,0|2,0,0]=4 238 B15R2.4392 CCCC1OC(=O)Nc2ccccc21 Amb28040965 [1,0,0,1,0,0|2,0,0]=4 239 B15R2.4392 CNCC1CC(=O)Nc2ccccc21 Amb24507120 [1,0,0,1,0,0|2,0,0]=4 240 B15R2.4392 O=C1CC(CCCl)c2ccccc2N1 Amb27387767 [1,0,0,1,0,0|2,0,0]=4 241 B15R2.4815 CCC1CNC(=O)Cc2ccccc21 Amb27983539 [1,0,0,1,0,0|1,0,1]=4 242 B15R2.4815 CCC1NCC(=O)Nc2ccccc21 Amb24645304 [1,0,0,1,0,0|2,0,0]=4 243 B15R2.16446 C\C(=C/c1ccccc1)CC2CNC2 Amb33476711 [1,0,0,1,0,0|1,0,1]=4 244 B15R2.16446 O=C(CC1CCC1)Nc2ccccc2 Amb6371420 [1,0,0,1,0,0|1,0,0]=3 245 B15R2.16446 O=C(NC1CCC1)Oc2ccccc2 Amb28124066 [1,0,0,1,0,0|2,0,0]=4 246 B15R2.21 F\C=C1\CCCCC1c2ccccc2 Amb27619790 [1,0,0,1,0,0|1,0,1]=4 247 B15R2.21 O=CC1=C(c2ccccc2)CCCC1 Amb27957735 [1,0,0,1,0,0|0,0,0]=2 248 B15R2.21 O=CC1=CCCCC1c2ccccc2 Amb27856841 [1,0,0,1,0,0|0,0,2]=4 249 B15R2.21 O=CC1=CCCC[C@@H]1c2ccccc2 Amb27189432 [1,0,0,1,0,0|0,0,2]=4 250 B15R2.21 O=CC1CCCCC1c2ccccc2 Amb18649999 [1,0,0,1,0,0|0,0,2]=4 251 B15R2.21 O=CC1CCCCN1c2ccccc2 Amb22494998 [1,0,0,1,0,0|1,0,1]=4 252 B15R2.21 O=CC1CCCC[C@@H]1c2ccccc2 Amb27585603 [1,0,0,1,0,0|0,0,2]=4 253 B15R2.21 O=C[C@H]1CCCC[C@H]1c2ccccc2 Amb27204875 [1,0,0,1,0,0|0,0,2]=4 254 B15R2.29 CC1CCC(=Cc2ccccc2)CC1 Amb4036507 [1,0,0,1,0,0|1,0,1]=4 255 B15R2.38 NC1CCCC\C1=C/c2ccccc2 Amb18129720 [1,0,0,1,0,0|1,0,1]=4 256 B15R2.38 O=C1C=CCC\C1=C/c2ccccc2 Amb2386555 [1,0,0,1,0,0|0,0,2]=4 257 B15R2.38 O=C1CCCCC1Cc2ccccc2 Amb3941676 [1,0,0,1,0,0|0,0,2]=4 258 B15R2.38 O=C1CCCCC1Nc2ccccc2 Amb6345715 [1,0,0,1,0,0|1,0,1]=4 259 B15R2.38 O=C1CCCCC1Oc2ccccc2 Amb3193923 [1,0,0,1,0,0|1,0,1]=4 260 B15R2.38 O=C1CCCCC1Sc2ccccc2 Amb3836196 [1,0,0,1,0,0|1,0,1]=4 261 B15R2.38 O=C1CCCCN1Cc2ccccc2 Amb9826065 [1,0,0,1,0,0|1,0,1]=4 262 B15R2.38 O=C1CCCC\C1=C/c2ccccc2 Amb33513197 [1,0,0,1,0,0|0,0,0]=2 263 B15R2.38 O=C1CCCC\C1=C/c2cccnc2 Amb24598643 [1,0,0,1,0,0|1,0,0]=3 264 B15R2.38 O=C1CCCC\C1=C/c2ccncc2 Amb1486636 [1,0,0,1,0,0|1,0,0]=3 265 B15R2.38 O=C1NCCC\C1=C/c2ccccc2 Amb8439773 [1,0,0,1,0,0|1,0,0]=3 266 B15R2.44 CCCn1c(C=O)cc2ccccc21 Amb32417759 [1,0,0,1,0,0|1,0,0]=3 267 B15R2.44 CCCn1c(C=O)nc2ccccc21 Amb1760888 [1,0,0,1,0,0|2,0,0]=4 268 B15R2.89 CCCCC1Cc2ccccc2C1=O Amb16232568 [1,0,0,1,0,0|0,0,2]=4 269 B15R2.89 CCCCN1Nc2ccccc2C1=O Amb24412853 [1,0,0,1,0,0|2,0,0]=4 270 B15R2.89 CCCCN1Sc2ccccc2C1=O Amb24617409 [1,0,0,1,0,0|2,0,0]=4 271 B15R2.89 CCCCN1[Se]c2ccccc2C1=O Amb33457516 [1,0,0,1,0,0|2,0,0]=4 272 B15R2.352 BrCCCc1ccc2ccccc2c1 Amb26339538 [1,0,0,1,0,0|2,0,0]=4 273 B15R2.352 BrCCCc1cnc2ccccc2c1 Amb26862798 [1,0,0,1,0,0|2,0,0]=4 274 B15R2.352 CCCCc1ccc2ccccc2c1 Amb9787702 [1,0,0,1,0,0|1,0,0]=3 275 B15R2.352 CCCCc1ccc2ccccc2n1 Amb4012109 [1,0,0,1,0,0|2,0,0]=4 276 B15R2.352 CCCCc1cnc2ccccc2c1 Amb27830570 [1,0,0,1,0,0|1,0,0]=3 277 B15R2.352 CCCOc1ccc2ccccc2c1 Amb4011084 [1,0,0,1,0,0|2,0,0]=4 278 B15R2.352 CCNCc1ccc2ccccc2c1 Amb6266033 [1,0,0,1,0,0|2,0,0]=4 279 B15R2.352 CCNCc1cnc2ccccc2c1 Amb1995113 [1,0,0,1,0,0|2,0,0]=4 280 B15R2.352 CNCCc1ccc2ccccc2c1 Amb8853663 [1,0,0,1,0,0|2,0,0]=4 281 B15R2.352 CNCCc1cnc2ccccc2c1 Amb18993609 [1,0,0,1,0,0|2,0,0]=4 282 B15R2.352 ClCCCc1ccc2ccccc2c1 Amb27181357 [1,0,0,1,0,0|2,0,0]=4 283 B15R2.352 NCCCc1ccc2ccccc2c1 Amb18981387 [1,0,0,1,0,0|2,0,0]=4 284 B15R2.352 NCCCc1cnc2ccccc2c1 Amb28046797 [1,0,0,1,0,0|2,0,0]=4 285 B15R2.352 OCCCc1ccc2ccccc2c1 Amb24401038 [1,0,0,1,0,0|2,0,0]=4 286 B15R2.352 OCCCc1cnc2ccccc2c1 Amb25365615 [1,0,0,1,0,0|2,0,0]=4 287 B15R2.352 SCCCc1ccc2ccccc2c1 Amb31132725 [1,0,0,1,0,0|2,0,0]=4 288 B15R2.352 SCCCc1cnc2ccccc2c1 Amb33319773 [1,0,0,1,0,0|2,0,0]=4 289 B15R2.1851 CCc1nc(C=O)cc2ccccc12 Amb27219447 [1,0,0,1,0,0|1,0,1]=4 290 B15R2.1 CNC1CC=C(c2ccccc2)CC1 Amb28291625 [0,0,0,1,1,0|2,0,0]=4 291 B15R2.1 OCC1CC=C(c2ccccc2)CC1 Amb28280888 [0,0,0,1,1,0|2,0,0]=4 292 B15R2.5 CCCCCn1ccc2ccccc21 Amb10559920 [0,0,0,1,1,0|2,0,0]=4 293 B15R2.5 CCCCCn1cnc2ccccc21 Amb1744548 [0,0,0,1,1,0|2,0,0]=4 294 B15R2.5 CCCNCc1csc2ccccc12 Amb19649472 [0,0,0,1,1,0|1,1,0]=4 295 B15R2.5 NCCCCc1csc2ccccc12 Amb33172230 [0,0,0,1,1,0|1,1,0]=4 296 B15R2.32 CC1=C(c2ccccc2)CCCC1O Amb27835154 [0,0,0,1,1,0|2,0,0]=4 297 B15R2.32 CC1NCCN(c2ccccc2)C1=O Amb10607565 [0,0,0,1,1,0|2,0,0]=4 298 B15R2.32 CC1NCCN(c2ccccc2)C1=O Amb22586865 [0,0,0,1,1,0|2,0,0]=4 299 B15R2.32 NC1CCCN(c2ccccc2)C1=O Amb19334736 [0,0,0,1,1,0|2,0,0]=4 300 B15R2.32 N[C@H]1CCCN(c2ccccc2)C1=O Amb27818215 [0,0,0,1,1,0|2,0,0]=4 301 B15R2.32 O=C1C(Br)CCCN1c2ccccc2 Amb19515204 [0,0,0,1,1,0|2,0,0]=4 302 B15R2.32 O=C1C(Cl)CCCC1c2ccccc2 Amb28074841 [0,0,0,1,1,0|1,0,1]=4 303 B15R2.32 O=C1[C@@H](Cl)CCC[C@H]1c2ccccc2 Amb27217971 [0,0,0,1,1,0|1,0,1]=4 304 B15R2.32 O=C1[C@@H](O)CCC[C@H]1c2ccccc2 Amb27220264 [0,0,0,1,1,0|1,0,1]=4 305 B15R2.32 O=C1[C@H](Cl)CCC[C@@H]1c2ccccc2 Amb27446642 [0,0,0,1,1,0|1,0,1]=4 306 B15R2.32 O=C1[C@H](c2ccccc2)CCC[C@H]1O Amb27969134 [0,0,0,1,1,0|1,0,1]=4 307 B15R2.66 OCCC1CC=C(c2ccccc2)C1 Amb28079050 [0,0,0,1,1,0|2,0,0]=4 308 B15R2.131 O=CC(=C1CCCC1)c2ccccc2 Amb17594835 [0,0,0,1,1,0|0,0,1]=3 309 B15R2.131 O=CC(c1ccccc1)C2CCCC2 Amb27862146 [0,0,0,1,1,0|0,0,1]=3 310 B15R2.131 O=CC(c1ccccc1)N2CCCC2 Amb28144029 [0,0,0,1,1,0|1,0,1]=4 311 B15R2.131 O=C[C@@H](c1ccccc1)C2CCCC2 Amb27589820 [0,0,0,1,1,0|0,0,1]=3 312 B15R2.131 O\N=C(\c1ccccc1)C2CCCC2 Amb24749408 [0,0,0,1,1,0|1,0,1]=4 313 B15R2.1331 O\N=C(\CC1CCC1)c2ccccc2 Amb27246272 [0,0,0,1,1,0|1,0,1]=4 314 B15R2.2169 C1=C(c2ccccc2)CCCOCC1 Amb6359581 [0,0,0,1,1,0|2,0,0]=4 315 B15R2.4808 CNC1CCN(c2ccccc2)C1=O Amb18283079 [0,0,0,1,1,0|2,0,0]=4 316 B15R2.4980 O=CC1(c2ccccc2)CCCCC1 Amb17401211 [0,0,0,1,1,0|0,0,1]=3 317 B15R2.4980 O=CC1(c2ccccn2)CCCCC1 Amb27186695 [0,0,0,1,1,0|1,0,1]=4 318 B15R2.11492 CCCN1CC(C=O)c2ccccc21 Amb23586337 [0,0,0,1,1,0|1,0,1]=4 319 B15R2.11492 CCCn1cc(C=O)c2ccccc21 Amb2721961 [0,0,0,1,1,0|1,0,1]=4 320 B15R2.11492 CCCn1nc(C=O)c2ccccc21 Amb23455185 [0,0,0,1,1,0|2,0,0]=4 321 B15R2.25515 CN1CCCC1(C=O)c2ccccc2 Amb28408818 [0,0,0,1,1,0|1,0,1]=4 322 B17R2.268 CCCNCc1ccc(-c2ccccc2)o1 Amb1929158 [0,0,0,1,0,1|2,0,0]=4 323 B17R2.268 CCCNCc1cnc(-c2ccccc2)s1 Amb2592593 [0,0,0,1,0,1|2,0,0]=4 324 B17R2.2708 NCCCCN1C=Cc2ccccc2C1=O Amb18035129 [0,0,0,1,0,1|2,0,0]=4 325 B17R2.2104 CCCCC(=O)c1ccc2ccccc2c1 Amb22263686 [0,1,0,1,0,0|1,0,1]=4 326 B17R2.2104 NCCCC(O)c1ccc2ccccc2c1 Amb18623697 [0,1,0,1,0,0|2,0,0]=4 327 B17R2.4563 CCNC1CCN(Cc2ccccc2)C1=O Amb19018001 [0,1,0,1,0,0|1,0,1]=4 328 B17R2.40592 O=C1CCC(O)CCN1Cc2ccccc2 Amb27653731 [0,1,0,1,0,0|1,0,1]=4 329 B17R2.2159 CCCC(Br)Cc1ccc2ccccc2c1 Amb18548970 [0,1,0,1,0,0|1,0,0]=3 330 B17R2.2159 NC(CCO)Cc1ccc2ccccc2c1 Amb32946594 [0,1,0,1,0,0|2,0,0]=4 331 B17R2.2418 CCC1CCN(Cc2ccccc2)CC1=O Amb22740179 [0,1,0,1,0,0|1,0,1]=4 332 B17R2.12080 CCCCCN1Cc2ccc(N)cc2C1=O Amb17483290 [0,1,0,1,0,0|1,0,1]=4 333 B17R2.73925 CCCCOc1ccc2cc(Br)ccc2c1 Amb2413132 [0,1,0,1,0,0|2,0,0]=4 334 B17R2.845676 CCCc1nc(C=O)cc2ccc(C)cc12 Amb31096668 [0,1,0,1,0,0|1,0,1]=4 335 B17R2.2015 COCCCc1ccc2ccc(O)cc2c1 Amb32751569 [0,1,0,1,0,0|2,0,0]=4 336 B17R2.6265 CCCCn1c(C=O)nc2cc(Cl)ccc21 Amb23442124 [0,1,0,1,0,0|2,0,0]=4 337 B17R2.103529 CCCCCc1ccc2c(N)nccc2c1 Amb18062854 [0,1,0,1,0,0|2,0,0]=4 338 B17R2.103529 CCCCCc1ccc2c(O)nccc2c1 Amb18560353 [0,1,0,1,0,0|2,0,0]=4 339 B17R2.219659 CCCc1nc(C=O)cc2cc(C)ccc12 Amb31096561 [0,1,0,1,0,0|1,0,1]=4 340 B17R2.26 NCC1CCCN(Cc2ccccc2)C1=O Amb26535113 [0,1,0,1,0,0|1,0,1]=4 341 B17R2.26 O=CC1CCC\C(=C/c2ccccc2)C1=O Amb1106636 [0,1,0,1,0,0|0,0,1]=3 342 B17R2.4602 CCCn1nnc(C=O)c1-c2ccccc2 Amb17534584 [0,1,0,1,0,0|2,0,0]=4 343 B17R2.5747 CCCCCn1c(C=O)nc2ccccc21 Amb1760890 [0,1,0,1,0,0|1,0,0]=3 344 B17R2.5747 CCOCCn1c(C=O)nc2ccccc21 Amb10976504 [0,1,0,1,0,0|2,0,0]=4 345 B17R2.5747 COCCCn1c(C=O)nc2ccccc21 Amb10976503 [0,1,0,1,0,0|2,0,0]=4 346 B17R2.5879 CCNCCOc1ccc2ccccc2c1 Amb7761800 [0,1,0,1,0,0|2,0,0]=4 347 B17R2.5879 CNCCCOc1ccc2ccccc2c1 Amb7798608 [0,1,0,1,0,0|2,0,0]=4 348 B17R2.5879 COCCNCc1cnc2ccccc2c1 Amb19649749 [0,1,0,1,0,0|2,0,0]=4 349 B17R2.5879 O=CCCCCc1ccc2ccccc2c1 Amb18549433 [0,1,0,1,0,0|1,0,1]=4 350 B17R2.12988 O=CC1(Sc2ccccc2)CCCCCC1 Amb17596426 [0,1,0,1,0,0|1,0,1]=4 351 B17R2.19956 CC1CCCCN(Cc2ccccc2)C1=O Amb32409888 [0,1,0,1,0,0|1,0,1]=4 352 B17R2.19956 CC1CNCCN(Cc2ccccc2)C1=O Amb26958148 [0,1,0,1,0,0|1,0,1]=4 353 B17R2.19956 CC1NCCCN(Cc2ccccc2)C1=O Amb25844113 [0,1,0,1,0,0|1,0,1]=4 354 B17R2.19956 CC1OCCCN(Cc2ccccc2)C1=O Amb25063467 [0,1,0,1,0,0|1,0,1]=4 355 B17R2.19956 C[C@H]1NCCCN(Cc2ccccc2)C1=O Amb26613140 [0,1,0,1,0,0|1,0,1]=4 356 B17R2.19956 NC1CCCCN(Cc2ccccc2)C1=O Amb25090886 [0,1,0,1,0,0|1,0,1]=4 357 B17R2.19956 N[C@H]1CCCCN(Cc2ccccc2)C1=O Amb16234028 [0,1,0,1,0,0|1,0,1]=4 358 B17R2.10270 CCCCCN1C(=O)c2ccccc2C1=O Amb6839999 [0,1,0,1,0,0|1,0,0]=3 359 B17R2.10270 CCCCON1C(=O)c2ccccc2C1=O Amb5794716 [0,1,0,1,0,0|2,0,0]=4 360 B17R2.10270 CNCCCN1C(=O)c2ccccc2C1=O Amb19015453 [0,1,0,1,0,0|2,0,0]=4 361 B17R2.10270 CNCCCN1C(=O)c2ccccc2C1=O Amb20241178 [0,1,0,1,0,0|2,0,0]=4 362 B17R2.10270 COCCCN1C(=O)c2ccccc2C1=O Amb2102006 [0,1,0,1,0,0|2,0,0]=4 363 B17R2.10270 NCCCCN1C(=O)c2ccccc2C1=O Amb19341305 [0,1,0,1,0,0|2,0,0]=4 364 B17R2.10270 NCCCCN1C(=O)c2ccccc2C1=O Amb6245271 [0,1,0,1,0,0|2,0,0]=4 365 B17R2.10270 O=C1c2ccccc2C(=O)N1CCCCBr Amb1204235 [0,1,0,1,0,0|2,0,0]=4 366 B17R2.10270 O=C1c2ccccc2C(=O)N1CCCCO Amb9370469 [0,1,0,1,0,0|2,0,0]=4 367 B17R2.12072 CCCCCc1nc(Cl)c2ccccc2n1 Amb33249891 [0,1,0,1,0,0|2,0,0]=4 368 B17R2.12072 CCCCCc1nc(O)c2ccccc2n1 Amb33249887 [0,1,0,1,0,0|1,0,1]=4 369 B17R2.12072 CCCCSC1=Nc2ccccc2C(=O)N1 Amb21867766 [0,1,0,1,0,0|2,0,0]=4 370 B17R2.12072 COCCNC1=Cc2ccccc2C(=O)N1 Amb18304253 [0,1,0,1,0,0|2,0,0]=4 371 B17R2.6436 CCCCn1c(C(C)=O)nc2ccccc21 Amb21811536 [0,1,0,1,0,0|2,0,0]=4 372 B17R2.6436 COCCn1c(C(=O)O)cc2ccccc21 Amb1099148 [0,1,0,1,0,0|2,0,0]=4 373 B17R2.12116 NCCCCc1cc2ccccc2nc1Cl Amb33057302 [0,1,0,1,0,0|2,0,0]=4 374 B17R2.45267 NC(=O)C1(Nc2ccccc2)CCCCC1 Amb10609603 [0,1,0,1,0,0|1,0,1]=4 375 B17R2.45267 NC(=O)C1(Oc2ccccc2)CCCCC1 Amb17405293 [0,1,0,1,0,0|1,0,1]=4 376 B17R2.45267 O=C(O)C1(Cc2ccccc2)CCCCC1 Amb6359359 [0,1,0,1,0,0|0,0,2]=4 377 B17R2.45267 O=C(O)C1(Nc2ccccc2)CCCCC1 Amb2690259 [0,1,0,1,0,0|1,0,1]=4 378 B17R2.45267 O=C(O)C1(Oc2ccccc2)CCCCC1 Amb2149368 [0,1,0,1,0,0|1,0,1]=4 379 B17R2.89821 CCCc1nc(C(=O)O)cc2ccccc12 Amb31096510 [0,1,0,1,0,0|1,0,1]=4 380 B17R2.1261 CC(C)Cc1nc(C=O)cc2ccccc12 Amb31096518 [0,1,0,1,0,0|1,0,1]=4 381 B17R2.1273 CC(C)CCn1c(C=O)nc2ccccc21 Amb1760889 [0,1,0,1,0,0|2,0,0]=4 382 B17R2.20439 CC(O)C1CCN(Cc2ccccc2)C1=O Amb27623713 [0,1,0,1,0,0|1,0,1]=4 383 B17R2.2023 CCCCOc1ccc2cccc(O)c2c1 Amb35745234 [0,1,0,1,0,0|2,0,0]=4 384 B17R2.219656 CCCc1nc(C=O)cc2c(C)cccc12 Amb31096614 [0,1,0,1,0,0|1,0,1]=4 385 B17R2.1262 CCC(C)c1nc(C=O)cc2ccccc12 Amb31096517 [0,1,0,1,0,0|1,0,1]=4 386 B17R2.1274 CCC(C)Cn1c(C=O)nc2ccccc21 Amb17748822 [0,1,0,1,0,0|2,0,0]=4 387 B17R2.5355 C[C@@H]1C(=O)N(Cc2ccccc2)CC[C@H]1N Amb27234766 [0,1,0,1,0,0|1,0,1]=4 388 B17R3.7803 O=C1C2CC(C2)CN1Cc3ccccc3 Amb27784881 [0,0,0,2,0,0|1,0,1]=4 389 B17R3.33545 O=C1C2CCCC1Cc3ccccc3C2 Amb32666278 [0,0,0,2,0,0|0,0,2]=4 390 B17R3.33545 O=C1[C@H]2CCC[C@@H]1Cc3ccccc3C2 Amb28906294 [0,0,0,2,0,0|0,0,2]=4 391 B17R3.50126 OC1CCCc2cc3ccccc3nc21 Amb21962961 [0,0,0,2,0,0|2,0,0]=4 392 B17R3.1917 c1ccc2cc(C3CCCN3)ccc2c1 Amb17659177 [0,0,0,2,0,0|2,0,0]=4 393 B17R3.1917 c1ccc2cc(C3CCCN3)ccc2c1 Amb2694006 [0,0,0,2,0,0|2,0,0]=4 394 B17R3.1917 c1ccc2cc(C3CCNC3)ccc2c1 Amb19082709 [0,0,0,2,0,0|2,0,0]=4 395 B17R3.1917 c1ccc2ncc(C3CCCN3)cc2c1 Amb10606891 [0,0,0,2,0,0|2,0,0]=4 396 B17R3.1917 c1ccc2ncc(C3CCCN3)cc2c1 Amb3788667 [0,0,0,2,0,0|2,0,0]=4 397 B17R3.1917 c1ccc2ncc(C3CCNC3)cc2c1 Amb33358804 [0,0,0,2,0,0|2,0,0]=4 398 B17R3.1917 c1ccc2ncc(N3CCCC3)cc2c1 Amb18269687 [0,0,0,2,0,0|2,0,0]=4 399 B17R3.844 O=Cc1nc2ccccc2n1C3CCC3 Amb27627977 [0,0,0,2,0,0|2,0,0]=4 400 B17R3.209229 O=C1N(Cc2ccccc2)CCC13CC3 Amb22899298 [0,0,0,2,0,0|1,0,1]=4 401 B17R3.648661 c1ccc2cc(CNC3CC3)ccc2c1 Amb1115614 [0,0,0,2,0,0|2,0,0]=4 402 B17R3.648661 c1ccc2ncc(CNC3CC3)cc2c1 Amb1995208 [0,0,0,2,0,0|2,0,0]=4 403 B17R3.648661 c1ccc2ncc(NCC3CC3)cc2c1 Amb9556895 [0,0,0,2,0,0|2,0,0]=4 404 B17R3.16594 NCC1CC1c2ccc3ccccc3c2 Amb19066048 [0,0,0,2,0,0|2,0,0]=4 405 B17R3.16594 NCC1CC1c2cnc3ccccc3c2 Amb33323519 [0,0,0,2,0,0|2,0,0]=4 406 B17R3.16594 NC[C@@H]1C[C@H]1c2ccc3ccccc3c2 Amb33362156 [0,0,0,2,0,0|2,0,0]=4 407 B17R3.16594 NC[C@@H]1C[C@H]1c2cnc3ccccc3c2 Amb33323558 [0,0,0,2,0,0|2,0,0]=4 408 B17R3.74 O=C1c2ccccc2NC13CCCCC3 Amb32653653 [0,0,0,2,0,0|1,0,1]=4 409 B17R3.3428 O=C1c2ccccc2CC1CC3CCC3 Amb27240381 [0,0,0,2,0,0|0,0,2]=4 410 B17R3.123564 c1ccc2cc(CC3CNC3)ccc2c1 Amb1123783 [0,0,0,2,0,0|2,0,0]=4 411 B17R3.123564 c1ccc2ncc(CC3CNC3)cc2c1 Amb33324498 [0,0,0,2,0,0|2,0,0]=4 412 B17R3.123564 c1ccc2ncc(NC3CCC3)cc2c1 Amb19083692 [0,0,0,2,0,0|2,0,0]=4 413 B13R1.24 C=CCCCC(=O)c1ccccc1 Amb31307896 [1,0,0,0,1,0|0,0,2]=4 414 B13R1.24 CC#CCCC(=O)c1ccccc1 Amb18802901 [1,0,0,0,1,0|0,0,2]=4 415 B13R1.24 CCCCCC(=O)c1ccccc1 Amb6608934 [1,0,0,0,1,0|0,0,0]=2 416 B13R1.24 CCCCCC(=O)c1ccccn1 Amb6301473 [1,0,0,0,1,0|1,0,0]=3 417 B13R1.24 CCCCCC(=O)c1cccnc1 Amb18184182 [1,0,0,0,1,0|1,0,0]=3 418 B13R1.24 CCCCCC(=O)c1ccncc1 Amb18804653 [1,0,0,0,1,0|1,0,0]=3 419 B13R1.24 CCCCCC(=O)c1cnccn1 Amb18184370 [1,0,0,0,1,0|2,0,0]=4 420 B13R1.24 CCCCCC(N)c1ccccc1 Amb7764725 [1,0,0,0,1,0|1,0,1]=4 421 B13R1.24 CCCCCC(O)c1ccccc1 Amb9619574 [1,0,0,0,1,0|0,0,2]=4 422 B13R1.24 CCCCCC(S)c1ccccc1 Amb32788166 [1,0,0,0,1,0|0,1,1]=4 423 B13R1.24 CCCCOC(=O)c1ccccc1 Amb6357093 [1,0,0,0,1,0|1,0,0]=3 424 B13R1.24 CCCCOC(=O)c1ccccn1 Amb4019959 [1,0,0,0,1,0|2,0,0]=4 425 B13R1.24 CCCCOC(=O)c1cccnc1 Amb17509605 [1,0,0,0,1,0|2,0,0]=4 426 B13R1.24 CCCSCC(=O)c1ccccc1 Amb9668634 [1,0,0,0,1,0|1,0,0]=3 427 B13R1.24 CCOCNC(=O)c1ccccc1 Amb24072678 [1,0,0,0,1,0|2,0,0]=4 428 B13R1.24 CCSCCC(=O)c1ccccc1 Amb32683148 [1,0,0,0,1,0|1,0,0]=3 429 B13R1.24 CNCCNC(=O)c1ccccc1 Amb19028050 [1,0,0,0,1,0|2,0,0]=4 430 B13R1.24 CSCCCC(=O)c1ccccc1 Amb18321257 [1,0,0,0,1,0|1,0,0]=3 431 B13R1.24 N#CCCCC(=O)c1ccccc1 Amb4376113 [1,0,0,0,1,0|1,0,1]=4 432 B13R1.24 NCCCNC(=O)c1ccccc1 Amb33506255 [1,0,0,0,1,0|2,0,0]=4 433 B13R1.24 NCCCNC(=O)c1ccccc1 Amb6281166 [1,0,0,0,1,0|2,0,0]=4 434 B13R1.24 NCCOCC(=O)c1ccccc1 Amb18111539 [1,0,0,0,1,0|2,0,0]=4 435 B13R1.24 O=C(CCCCCl)c1ccccc1 Amb6301784 [1,0,0,0,1,0|1,0,0]=3 436 B13R1.24 O=C(CSCCO)c1ccccc1 Amb4165982 [1,0,0,0,1,0|2,0,0]=4 437 B13R1.24 O=C(NCCCCl)c1ccccc1 Amb3887000 [1,0,0,0,1,0|2,0,0]=4 438 B13R1.24 O=C(NCCCO)c1ccccc1 Amb9243498 [1,0,0,0,1,0|2,0,0]=4 439 B13R1.24 O=C(OCCCCl)c1ccccc1 Amb24099970 [1,0,0,0,1,0|2,0,0]=4 440 B15R1.78 CCCCCC(=O)NCc1ccccc1 Amb3360906 [1,0,0,0,0,1|0,0,1]=3 441 B15R1.78 CCCCCC(=O)OCc1ccccc1 Amb22734264 [1,0,0,0,0,1|0,0,1]=3 442 B15R1.78 CCCCNC(=O)CNc1ccccc1 Amb17140118 [1,0,0,0,0,1|1,0,1]=4 443 B15R1.78 CCCCNC(=O)OCc1ccccc1 Amb3988246 [1,0,0,0,0,1|1,0,1]=4 444 B15R1.78 CCCCOC(=O)NCc1ccccc1 Amb3106123 [1,0,0,0,0,1|1,0,1]=4 445 B15R1.78 CCCCOC(=O)\C=C\c1ccccc1 Amb8392073 [1,0,0,0,0,1|1,0,0]=3 446 B15R1.78 CNCCCC(=O)OCc1ccccc1 Amb27610831 [1,0,0,0,0,1|1,0,1]=4 447 B15R1.78 COCCCC(=O)OCc1ccccc1 Amb29838335 [1,0,0,0,0,1|1,0,1]=4 448 B15R1.78 NCCCCC(=O)OCc1ccccc1 Amb17608237 [1,0,0,0,0,1|1,0,1]=4 449 B15R1.78 NCCCCC(=O)OCc1ccccc1 Amb24271768 [1,0,0,0,0,1|1,0,1]=4 450 B15R1.78 NCCCCC(=O)OCc1ccccc1 Amb26477625 [1,0,0,0,0,1|1,0,1]=4 451 B15R1.78 NCCCNC(=O)\C=C\c1ccccc1 Amb32652076 [1,0,0,0,0,1|2,0,0]=4 452 B15R1.78 NCCCNC(=O)\C=C\c1ccccc1 Amb32652077 [1,0,0,0,0,1|2,0,0]=4 453 B15R1.78 O=C(CCCCBr)NCc1ccccc1 Amb17274561 [1,0,0,0,0,1|1,0,1]=4 454 B15R1.78 O=C(CCCCO)NCc1ccccc1 Amb8593338 [1,0,0,0,0,1|1,0,1]=4 455 B15R1.78 O=C(CCCCO)OCc1ccccc1 Amb25832761 [1,0,0,0,0,1|1,0,1]=4 456 B15R1.78 O=C(\C=C\c1ccccc1)NCCCO Amb5799195 [1,0,0,0,0,1|2,0,0]=4