0 B16R1.13650 CCOC(=O)C(Cc1ccccc1)C(=O)O Amb4126282 [0,0,0,0,0,0|1,0,2]=3 1 B16R1.13650 CCOC(=O)C(Cc1ccccc1)C(C)=O Amb9758545 [0,0,0,0,0,0|0,0,2]=2 2 B16R1.13650 CCOC(=O)C(Oc1ccccc1)C(C)=O Amb17596052 [0,0,0,0,0,0|1,0,1]=2 3 B16R1.13650 CCOC(=O)C(Oc1ccccc1)C(C)C Amb17912815 [0,0,0,0,0,0|2,0,2]=4 4 B16R1.13650 CCOC(=O)\C(=C/c1ccccc1)C(C)=O Amb4318445 [0,0,0,0,0,0|0,0,0]=0 5 B16R1.13650 CCOC(=O)\C(=C\c1ccccc1)C(C)=O Amb9796492 [0,0,0,0,0,0|0,0,0]=0 6 B15R1.640 CCOC(=O)C(C=O)Cc1ccccc1 Amb23441824 [1,0,0,0,0,0|0,0,2]=3 7 B15R1.640 CCOC(=O)C(Cc1ccccc1)NC Amb19287768 [1,0,0,0,0,0|1,0,2]=4 8 B15R1.640 CCOC(=O)C(Cc1ccccc1)NC Amb22058808 [1,0,0,0,0,0|1,0,2]=4 9 B15R1.640 CCOC(=O)[C@@H](Cc1ccccc1)NC Amb33803412 [1,0,0,0,0,0|1,0,2]=4 10 B15R1.640 CCOC(=O)[C@H](Cc1ccccc1)NC Amb33802732 [1,0,0,0,0,0|1,0,2]=4 11 B15R1.640 CCOC(=O)\C(C#N)=C/c1ccccc1 Amb6541093 [1,0,0,0,0,0|1,0,1]=3 12 B15R1.640 CCOC(=O)\C(C#N)=C/c1cccnc1 Amb7173700 [1,0,0,0,0,0|2,0,1]=4 13 B15R1.640 CCOC(=O)\C(C#N)=C\c1ccccc1 Amb4020041 [1,0,0,0,0,0|1,0,1]=3 14 B15R1.640 CCOC(=O)\C(C#N)=C\c1ccccn1 Amb3374029 [1,0,0,0,0,0|2,0,1]=4 15 B15R1.640 CCOC(=O)\C(C#N)=C\c1cccnc1 Amb24077182 [1,0,0,0,0,0|2,0,1]=4 16 B15R1.640 CCOC(=O)\C(C#N)=C\c1ccncc1 Amb3205411 [1,0,0,0,0,0|2,0,1]=4 17 B15R1.4686 COC(=O)C(Cc1ccccc1)C(C)=O Amb17595501 [1,0,0,0,0,0|0,0,2]=3 18 B15R1.4686 COC(=O)\C(=C\c1cccnc1)C(=O)O Amb32405931 [1,0,0,0,0,0|2,0,0]=3 19 B17R1.18485 CCOC(=O)C(Cc1cccc(C)c1)C(C)=O Amb17251419 [0,1,0,0,0,0|0,0,2]=3 20 B17R1.18485 CCOC(=O)C(Cc1cccc(Cl)c1)C(C)=O Amb17264115 [0,1,0,0,0,0|0,0,2]=3 21 B17R1.18493 CCOC(=O)C(Cc1ccccc1C)C(C)=O Amb17251417 [0,1,0,0,0,0|0,0,2]=3 22 B17R1.18493 CCOC(=O)C(Cc1ccccc1F)C(C)=O Amb2688041 [0,1,0,0,0,0|0,0,2]=3 23 B17R1.21041 CCOC(=O)C(C(=O)c1ccccc1)C(C)C Amb22059002 [0,1,0,0,0,0|1,0,2]=4 24 B17R1.21041 CCOC(=O)C(C(C)=O)C(=O)c1ccccc1 Amb1950560 [0,1,0,0,0,0|0,0,1]=2 25 B17R1.21042 CCOC(=O)C(Cc1ccc(Br)cc1)C(C)=O Amb17294896 [0,1,0,0,0,0|0,0,2]=3 26 B17R1.21042 CCOC(=O)C(Cc1ccc(C)cc1)C(C)=O Amb8484068 [0,1,0,0,0,0|0,0,2]=3 27 B17R1.21042 CCOC(=O)C(Cc1ccc(Cl)cc1)C(C)=O Amb9758544 [0,1,0,0,0,0|0,0,2]=3 28 B17R1.21042 CCOC(=O)C(Cc1ccc(F)cc1)C(C)=O Amb2440987 [0,1,0,0,0,0|0,0,2]=3 29 B17R1.21042 CCOC(=O)C(Oc1ccc(C)cc1)C(C)=O Amb22285051 [0,1,0,0,0,0|1,0,1]=3 30 B17R1.21042 CCOC(=O)C(Oc1ccc(Cl)cc1)C(C)=O Amb17621605 [0,1,0,0,0,0|1,0,1]=3 31 B17R2.2360 CC1CC(=O)N(Cc2ccccc2)C(=O)N1 Amb27393014 [0,0,0,1,0,0|2,0,1]=4 32 B17R2.2634 CCN1CC(=O)N(Cc2ccccc2)C1=O Amb28324798 [0,0,0,1,0,0|2,0,1]=4 33 B17R2.3353 CN1OC(=O)C(C(=O)O)=C1c2ccccc2 Amb18067464 [0,0,0,1,0,0|2,0,0]=3 34 B17R2.3353 CN1OC(=O)C(C(=O)O)=C1c2ccccn2 Amb18068020 [0,0,0,1,0,0|3,0,0]=4 35 B17R2.3353 CN1OC(=O)C(C(=O)O)=C1c2cccnc2 Amb18068022 [0,0,0,1,0,0|3,0,0]=4 36 B17R2.3353 CN1OC(=O)C(C(=O)O)=C1c2ccncc2 Amb18068023 [0,0,0,1,0,0|3,0,0]=4 37 B17R2.3353 Cc1oc(C)c(-c2ccccc2)c1C(=O)O Amb9795477 [0,0,0,1,0,0|2,0,1]=4 38 B17R2.4716 CCOc1cc2ccccc2cc1C(=O)O Amb86682 [0,0,0,1,0,0|2,0,0]=3 39 B17R2.4716 CCOc1nc2ccccc2cc1C(=O)O Amb7778341 [0,0,0,1,0,0|2,0,0]=3 40 B17R2.4716 CCOc1nc2ccccc2nc1C(=O)O Amb15695307 [0,0,0,1,0,0|3,0,0]=4 41 B17R2.16326 CCN1C(=O)C(C(=O)O)=Cc2ccccc21 Amb20414180 [0,0,0,1,0,0|2,0,0]=3 42 B17R2.16326 CCN1C(=O)C(C(=O)O)=Nc2ccccc21 Amb20407017 [0,0,0,1,0,0|3,0,0]=4 43 B17R2.16326 CCn1c(=O)c(C(C)O)cc2ccccc21 Amb5722592 [0,0,0,1,0,0|1,0,2]=4 44 B17R2.50008 CCOC(=O)C1=C(C)Nc2ccccc2S1 Amb6340911 [0,0,0,1,0,0|2,0,0]=3 45 B17R2.50008 CCOC(=O)C1=C(C)Sc2ccccc2N1 Amb9768255 [0,0,0,1,0,0|1,1,0]=3 46 B17R2.50008 CCOC(=O)C1=Cc2ccccc2NC1=O Amb20027958 [0,0,0,1,0,0|1,0,0]=2 47 B17R2.50008 CCOC(=O)C1=Cc2ccccc2OC1=O Amb19665021 [0,0,0,1,0,0|1,0,0]=2 48 B17R2.50008 CCOC(=O)C1=Cc2ccccc2OC1=S Amb21948588 [0,0,0,1,0,0|1,0,1]=3 49 B17R2.50008 CCOC(=O)C1=Cc2cccnc2NC1=O Amb18023997 [0,0,0,1,0,0|2,0,0]=3 50 B17R2.50008 CCOC(=O)C1=Cc2cnccc2NC1=O Amb32418302 [0,0,0,1,0,0|2,0,0]=3 51 B17R2.50008 CCOC(=O)C1=Nc2ccccc2NC1=O Amb19667291 [0,0,0,1,0,0|2,0,0]=3 52 B17R2.50008 CCOC(=O)C1Cc2ccccc2NC1=O Amb20075991 [0,0,0,1,0,0|1,0,2]=4 53 B17R2.50008 CCOC(=O)C1Oc2ccccc2NC1=O Amb10074165 [0,0,0,1,0,0|2,0,1]=4 54 B17R2.50008 CCOC(=O)C1Sc2ccccc2NC1=O Amb2445297 [0,0,0,1,0,0|2,0,1]=4 55 B17R2.50008 CCOC(=O)c1cc2ccccc2cc1I Amb9677289 [0,0,0,1,0,0|1,0,1]=3 56 B17R2.50008 CCOC(=O)c1cc2ccccc2cc1N Amb7762507 [0,0,0,1,0,0|1,0,1]=3 57 B17R2.50008 CCOC(=O)c1cc2ccccc2cc1O Amb1205552 [0,0,0,1,0,0|0,0,2]=3 58 B17R2.50008 CCOC(=O)c1cc2ccccc2nc1C Amb1799203 [0,0,0,1,0,0|1,0,0]=2 59 B17R2.50008 CCOC(=O)c1cc2ccccc2nc1Cl Amb8630441 [0,0,0,1,0,0|2,0,0]=3 60 B17R2.50008 CCOC(=O)c1cc2ccccc2nc1N Amb1084711 [0,0,0,1,0,0|2,0,0]=3 61 B17R2.50008 CCOC(=O)c1cc2cccnc2cc1Cl Amb32665112 [0,0,0,1,0,0|2,0,1]=4 62 B17R2.50008 CCOC(=O)c1cc2cccnc2cc1O Amb30625613 [0,0,0,1,0,0|1,0,2]=4 63 B17R2.50008 CCOC(=O)c1cc2cccnc2nc1Cl Amb9175251 [0,0,0,1,0,0|3,0,0]=4 64 B17R2.50008 CCOC(=O)c1cc2cccnc2nc1N Amb18658077 [0,0,0,1,0,0|3,0,0]=4 65 B17R2.50008 CCOC(=O)c1cc2ccncc2nc1O Amb18132742 [0,0,0,1,0,0|2,0,1]=4 66 B17R2.50008 CCOC(=O)c1cc2cnccc2nc1C Amb4557959 [0,0,0,1,0,0|2,0,0]=3 67 B17R2.50008 CCOC(=O)c1nc2ccccc2cc1C Amb22498219 [0,0,0,1,0,0|2,0,0]=3 68 B17R2.50008 CCOC(=O)c1nc2ccccc2cc1Cl Amb33624216 [0,0,0,1,0,0|2,0,1]=4 69 B17R2.50008 CCOC(=O)c1nc2ccccc2cc1N Amb28556795 [0,0,0,1,0,0|2,0,1]=4 70 B17R2.50008 CCOC(=O)c1nc2ccccc2nc1C Amb2666499 [0,0,0,1,0,0|2,0,0]=3 71 B17R2.50008 CCOC(=O)c1nc2ccccc2nc1Cl Amb13892081 [0,0,0,1,0,0|3,0,0]=4 72 B17R2.50008 CCOC(=O)c1nc2ccccc2nc1O Amb2223389 [0,0,0,1,0,0|2,0,1]=4 73 B15R1.9922 CCOC(=O)C(C(=O)O)c1ccccc1 Amb2783663 [0,0,0,0,1,0|1,0,1]=3 74 B15R1.9922 CCOC(=O)C(C(C)=O)c1ccccc1 Amb6357470 [0,0,0,0,1,0|0,0,1]=2 75 B15R1.9922 CCOC(=O)C(C(C)=O)c1cccnc1 Amb22492456 [0,0,0,0,1,0|1,0,1]=3 76 B17R1.5389 CCOC(=O)CN(Cc1ccccc1)C(C)=O Amb24599961 [0,0,0,0,0,1|1,0,1]=3 77 B17R1.5389 CCOC(=O)CN(Cc1ccccc1)S(C)=O Amb27774831 [0,0,0,0,0,1|2,0,1]=4 78 B17R1.5389 CCOC(=O)NC(Cc1ccccc1)C(=O)O Amb6247863 [0,0,0,0,0,1|1,0,2]=4 79 B17R1.5389 CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)O Amb2747401 [0,0,0,0,0,1|1,0,2]=4 80 B17R1.5389 CCOC(=O)N[C@H](Cc1ccccc1)C(=O)O Amb32655852 [0,0,0,0,0,1|1,0,2]=4 81 B17R1.5402 CCOC(=O)C(CCc1ccccc1)C(C)=O Amb19652167 [0,0,0,0,0,1|0,0,2]=3 82 B17R1.5402 CCOC(=O)\C(=N\Nc1ccccc1)C(C)=O Amb1196008 [0,0,0,0,0,1|1,0,0]=2 83 B17R1.18492 CCOC(=O)C(Cc1ccccc1)NC(C)=O Amb3997934 [0,0,0,0,0,1|0,0,2]=3 84 B17R1.18492 CCOC(=O)[C@H](Cc1ccccc1)NC(C)=O Amb10844846 [0,0,0,0,0,1|0,0,2]=3 85 B14R1.60 CCNC(=O)C(=O)Cc1ccccc1 Amb17401495 [2,0,0,0,0,0|1,0,1]=4 86 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 Amb1814008 [2,0,0,0,0,0|2,0,0]=4 87 B14R1.60 CCOC(=O)C(=O)C[n+]1ccccc1 Amb32456074 [2,0,0,0,0,0|1,0,1]=4 88 B14R1.60 CCOC(=O)C(=O)Cc1ccccc1 Amb28989403 [2,0,0,0,0,0|0,0,1]=3 89 B14R1.60 CCOC(=O)C(=O)Cc1ccncc1 Amb9201724 [2,0,0,0,0,0|1,0,1]=4 90 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 Amb1196006 [2,0,0,0,0,0|1,0,0]=3 91 B14R1.60 CCOC(=O)C(=O)Nc1ccccn1 Amb3886949 [2,0,0,0,0,0|2,0,0]=4 92 B14R1.60 CCOC(=O)C(=O)Nc1cccnc1 Amb3886946 [2,0,0,0,0,0|2,0,0]=4 93 B14R1.60 CCOC(=O)C(=O)Nc1ccncc1 Amb5794362 [2,0,0,0,0,0|2,0,0]=4 94 B14R1.60 CCOC(=O)C(=O)Oc1ccccn1 Amb24103622 [2,0,0,0,0,0|2,0,0]=4 95 B14R1.60 CCOC(=O)N(C)Cc1ccccc1 Amb3095224 [2,0,0,0,0,0|1,0,1]=4 96 B14R1.60 CCOC(=O)\C(C)=C\c1ccccn1 Amb32664894 [2,0,0,0,0,0|1,0,0]=3 97 B14R1.60 CCOC(=O)\C(C)=C\c1cccnc1 Amb32664895 [2,0,0,0,0,0|1,0,0]=3 98 B14R1.60 CCOC(=O)\C(Cl)=C\c1ccccc1 Amb32425173 [2,0,0,0,0,0|1,0,0]=3 99 B14R1.60 CCOC(=O)\C([O-])=C\c1ccncc1 Amb19506687 [2,0,0,0,0,0|1,0,1]=4 100 B14R1.60 CNCC(=O)\C(C)=C\c1ccccc1 Amb33476419 [2,0,0,0,0,0|2,0,0]=4 101 B14R1.60 C\C(=C/c1ccccc1)C(=O)CCN Amb33476404 [2,0,0,0,0,0|2,0,0]=4 102 B14R1.1031 COC(=O)\C(=C\c1ccccc1)CN Amb18650860 [2,0,0,0,0,0|1,0,1]=4 103 B14R1.1031 COC(=O)\C(=C\c1ccccc1)CN Amb32413923 [2,0,0,0,0,0|1,0,1]=4 104 B14R1.1031 COC(=O)\C(C#N)=C/c1ccccc1 Amb2701553 [2,0,0,0,0,0|1,0,1]=4 105 B14R1.1031 COC(=O)\C(C#N)=C\c1ccccc1 Amb10844663 [2,0,0,0,0,0|1,0,1]=4 106 B14R1.980 COC\C(=C/c1ccccc1)C(=O)O Amb5743981 [2,0,0,0,0,0|1,0,1]=4 107 B14R1.4513 C=C(C)\C(=C/c1ccccc1)C(=O)O Amb28137962 [2,0,0,0,0,0|1,0,0]=3 108 B14R1.4513 CC(=O)C(=Nc1ccccc1)C(C)=O Amb22232232 [2,0,0,0,0,0|1,0,0]=3 109 B14R1.4513 CC(=O)C(Cc1ccccc1)C(C)=O Amb17778962 [2,0,0,0,0,0|0,0,2]=4 110 B14R1.4513 CC(=O)C(Oc1ccccc1)C(C)=O Amb2726032 [2,0,0,0,0,0|1,0,1]=4 111 B14R1.4513 CC(=O)C(Sc1ccccc1)C(C)=O Amb32424885 [2,0,0,0,0,0|1,0,1]=4 112 B14R1.4513 CC(=O)\C(Cc1ccccc1)=C(\C)N Amb28381438 [2,0,0,0,0,0|1,0,1]=4 113 B14R1.4513 CC(C)=C(Oc1ccccc1)C(=O)O Amb18651146 [2,0,0,0,0,0|2,0,0]=4 114 B14R1.4513 CC(C)\C(=C/c1ccccc1)C(=O)O Amb17234888 [2,0,0,0,0,0|1,0,1]=4 115 B14R1.4513 CC(C)\C(=C\c1ccccc1)C(=O)O Amb27185860 [2,0,0,0,0,0|1,0,1]=4 116 B14R1.4513 CS(=O)\C(=C/c1ccccc1)C(=O)O Amb28133371 [2,0,0,0,0,0|1,0,0]=3 117 B14R1.4513 C[C@@H](O)\C(=C/c1ccccc1)C(=O)O Amb27807915 [2,0,0,0,0,0|0,0,2]=4 118 B14R1.4513 NC(=O)C(=Cc1ccccc1)C(N)=O Amb9813206 [2,0,0,0,0,0|2,0,0]=4 119 B14R1.4513 O=C(O)C(=Cc1ccccc1)C(=O)O Amb17595021 [2,0,0,0,0,0|1,0,0]=3 120 B14R1.4513 O=C(O)C(=Cc1cccnc1)C(=O)O Amb25809321 [2,0,0,0,0,0|2,0,0]=4 121 B16R1.743 CCOC(=O)C(C=O)Cc1ccc(F)cc1 Amb32422876 [1,1,0,0,0,0|0,0,2]=4 122 B16R1.743 CCOC(=O)\C(C#N)=C/c1ccc(Br)cc1 Amb6368902 [1,1,0,0,0,0|1,0,1]=4 123 B16R1.743 CCOC(=O)\C(C#N)=C/c1ccc(C)cc1 Amb3102105 [1,1,0,0,0,0|1,0,1]=4 124 B16R1.743 CCOC(=O)\C(C#N)=C/c1ccc(Cl)cc1 Amb3122266 [1,1,0,0,0,0|1,0,1]=4 125 B16R1.743 CCOC(=O)\C(C#N)=C\c1ccc(C)cc1 Amb6383978 [1,1,0,0,0,0|1,0,1]=4 126 B16R1.743 CCOC(=O)\C(C#N)=C\c1ccc(Cl)cc1 Amb2388699 [1,1,0,0,0,0|1,0,1]=4 127 B16R1.743 CCOC(=O)\C(C#N)=C\c1ccc(F)cc1 Amb1696271 [1,1,0,0,0,0|1,0,1]=4 128 B16R1.743 CCOC(=O)\C(C#N)=C\c1ccc(O)cc1 Amb6337436 [1,1,0,0,0,0|1,0,1]=4 129 B16R1.744 CCOC(=O)\C(C#N)=C/c1cccc(F)c1 Amb3122272 [1,1,0,0,0,0|1,0,1]=4 130 B16R1.744 CCOC(=O)\C(C#N)=C\c1cccc(C)c1 Amb3369917 [1,1,0,0,0,0|1,0,1]=4 131 B16R1.744 CCOC(=O)\C(C#N)=C\c1cccc(Cl)c1 Amb2763013 [1,1,0,0,0,0|1,0,1]=4 132 B16R1.744 CCOC(=O)\C(C#N)=C\c1cccc(O)c1 Amb2563374 [1,1,0,0,0,0|1,0,1]=4 133 B16R1.951 CCOC(=O)C(CC)C(=O)c1ccccc1 Amb22059001 [1,1,0,0,0,0|0,0,2]=4 134 B16R1.951 CCOC(=O)\C(=N/O)C(=O)c1ccccc1 Amb4020414 [1,1,0,0,0,0|1,0,1]=4 135 B16R1.951 CCOC(=O)\C(C#N)=C(/C)c1ccccc1 Amb1545489 [1,1,0,0,0,0|1,0,1]=4 136 B16R1.951 CCOC(=O)\C(C#N)=C(/O)c1ccccc1 Amb2496470 [1,1,0,0,0,0|1,0,1]=4 137 B16R1.951 CCOC(=O)\C(C#N)=C(\C)c1ccccc1 Amb22736534 [1,1,0,0,0,0|1,0,1]=4 138 B16R1.15117 CCOC(=O)\C(C#N)=C/c1ccccc1Cl Amb3122270 [1,1,0,0,0,0|1,0,1]=4 139 B16R1.15117 CCOC(=O)\C(C#N)=C/c1ccccc1O Amb32434929 [1,1,0,0,0,0|1,0,1]=4 140 B16R1.15117 CCOC(=O)\C(C#N)=C\c1ccccc1Br Amb2701530 [1,1,0,0,0,0|1,0,1]=4 141 B16R1.15117 CCOC(=O)\C(C#N)=C\c1ccccc1C Amb2764398 [1,1,0,0,0,0|1,0,1]=4 142 B16R1.15117 CCOC(=O)\C(C#N)=C\c1ccccc1Cl Amb2748613 [1,1,0,0,0,0|1,0,1]=4 143 B16R1.15117 CCOC(=O)\C(C#N)=C\c1ccccc1F Amb28985784 [1,1,0,0,0,0|1,0,1]=4 144 B16R1.5818 COC(=O)C(Cc1cccc(F)c1)C(C)=O Amb30623483 [1,1,0,0,0,0|0,0,2]=4 145 B16R1.5823 COC(=O)C(=Cc1ccccc1)C(=O)OC Amb4017812 [1,1,0,0,0,0|0,0,0]=2 146 B16R1.5823 COC(=O)C(=Cc1ccccn1)C(=O)OC Amb17341876 [1,1,0,0,0,0|1,0,0]=3 147 B16R1.5823 COC(=O)C(=Cc1cccnc1)C(=O)OC Amb17341877 [1,1,0,0,0,0|1,0,0]=3 148 B16R1.5823 COC(=O)C(=Cc1ccncc1)C(=O)OC Amb17341878 [1,1,0,0,0,0|1,0,0]=3 149 B16R1.5826 COC(=O)C(Cc1ccccc1Cl)C(C)=O Amb2685780 [1,1,0,0,0,0|0,0,2]=4 150 B16R1.5826 COC(=O)C(Cc1ccccc1F)C(C)=O Amb2688055 [1,1,0,0,0,0|0,0,2]=4 151 B16R1.5826 COC(=O)\C(=C\c1ccccc1Cl)C(C)=O Amb2699552 [1,1,0,0,0,0|0,0,0]=2 152 B16R1.16686 CO\C(C)=C(/C(C)=O)C(=O)c1ccccc1 Amb24119185 [1,1,0,0,0,0|1,0,0]=3 153 B16R1.16687 COC(=O)C(Cc1ccc(F)cc1)C(C)=O Amb2688056 [1,1,0,0,0,0|0,0,2]=4 154 B16R1.14942 CCOC(=O)C(C(C)=O)C(=O)c1cccs1 Amb2689990 [0,1,0,0,1,0|1,0,1]=4 155 B18R1.5634 CCOC(=O)NC(Cc1ccccc1)C(=O)CBr Amb32661693 [0,1,0,0,0,1|0,0,2]=4 156 B18R1.5658 CCOC(=O)\C(=N/Nc1cccc(Cl)c1)C(C)=O Amb3096995 [0,1,0,0,0,1|1,0,0]=3 157 B18R1.5664 CCOC(=O)\C(=N\Nc1ccccc1)C(=O)CCl Amb24056058 [0,1,0,0,0,1|1,0,0]=3 158 B18R1.25485 CCOC(=O)\C(=C/Nc1ccc(Cl)cc1)C(C)=O Amb19748189 [0,1,0,0,0,1|0,0,0]=2 159 B18R1.25485 CCOC(=O)\C(=N/Nc1ccc(C)cc1)C(C)=O Amb3096994 [0,1,0,0,0,1|1,0,0]=3 160 B18R1.25485 CCOC(=O)\C(=N\Nc1ccc(I)cc1)C(C)=O Amb6403426 [0,1,0,0,0,1|1,0,0]=3 161 B18R1.29027 CCOC(=O)C(CC(=O)c1ccccc1)C(C)=O Amb10131240 [0,1,0,0,0,1|0,0,1]=3 162 B18R1.29027 CCOC(=O)C(OC(=O)c1ccccc1)C(C)=O Amb33164137 [0,1,0,0,0,1|0,0,1]=3 163 B18R1.24220 CCOC(=O)C(Cc1ccccc1)NC(=O)CCl Amb17329213 [0,1,0,0,0,1|0,0,2]=4 164 B18R1.24250 CCOC(=O)[C@H](Cc1ccccc1O)OC(C)=O Amb33719517 [0,1,0,0,0,1|0,0,2]=4 165 B18R1.25483 CCOC(=O)C(CC(C)=O)C(=O)c1ccccc1 Amb32700793 [0,1,0,0,0,1|0,0,1]=3 166 B18R1.25483 CCOC(=O)C(CC(C)=O)C(=O)c1ccccn1 Amb32700899 [0,1,0,0,0,1|1,0,1]=4 167 B18R1.25483 CCOC(=O)C(CC(C)=O)C(=O)c1ccccn1 Amb32700929 [0,1,0,0,0,1|1,0,1]=4 168 B18R1.25483 CCOC(=O)C(CC(C)=O)C(=O)c1cccnc1 Amb32700834 [0,1,0,0,0,1|1,0,1]=4 169 B18R1.25483 CCOC(=O)C(CC(C)=O)C(=O)c1ccncc1 Amb32700900 [0,1,0,0,0,1|1,0,1]=4 170 B18R1.25483 CCOC(=O)\C(=C/N(C)C)C(=O)c1ccccc1 Amb34105082 [0,1,0,0,0,1|2,0,0]=4 171 B18R1.25483 CCOC(=O)\C(=C\N(C)C)C(=O)c1ccccc1 Amb22641859 [0,1,0,0,0,1|2,0,0]=4 172 B18R1.28793 CCOC(=O)C(Cc1ccc(O)cc1)NC(C)=O Amb4006678 [0,1,0,0,0,1|0,0,2]=4 173 B18R1.28793 CCOC(=O)C(Cc1ccc(O)cc1)NC(C)=O Amb4030559 [0,1,0,0,0,1|0,0,2]=4 174 B18R1.28793 CCOC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O Amb6356856 [0,1,0,0,0,1|0,0,2]=4 175 B18R1.28793 CCOC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O Amb8517054 [0,1,0,0,0,1|0,0,2]=4 176 B18R1.24221 CCOC(=O)C(=Cc1ccccc1)C(=O)OCC Amb4016948 [0,2,0,0,0,0|0,0,0]=2 177 B18R1.24221 CCOC(=O)C(=Cc1ccccn1)C(=O)OCC Amb22741058 [0,2,0,0,0,0|1,0,0]=3 178 B18R1.24221 CCOC(=O)C(=Cc1ccncc1)C(=O)OCC Amb1091174 [0,2,0,0,0,0|1,0,0]=3 179 B18R1.24221 CCOC(=O)C(Cc1ccccc1)C(=O)OCC Amb5559101 [0,2,0,0,0,0|0,0,2]=4 180 B18R1.24221 CCOC(=O)C(Nc1ccccc1)C(=O)OCC Amb2772882 [0,2,0,0,0,0|1,0,1]=4 181 B18R1.24221 CCOC(=O)N(Cc1ccccc1)C(=O)CC#N Amb5846330 [0,2,0,0,0,0|1,0,1]=4 182 B18R1.25474 CCOC(=O)\C(C(=O)c1ccccc1)=C(/C)NC Amb19651441 [0,2,0,0,0,0|1,0,0]=3 183 B18R1.214531 CCOC(=O)C(C(C)=O)C(=O)c1ccccc1F Amb2688037 [0,2,0,0,0,0|0,0,1]=3 184 B18R1.747842 CCOC(=O)C(Cc1c(F)cccc1Cl)C(C)=O Amb2410583 [0,2,0,0,0,0|0,0,2]=4 185 B18R1.747842 CCOC(=O)\C(=C\c1c(C)cccc1C)C(C)=O Amb32653205 [0,2,0,0,0,0|0,0,0]=2 186 B18R1.28791 CCOC(=O)C(C(C)=O)C(=O)c1ccc(F)cc1 Amb2688038 [0,2,0,0,0,0|0,0,1]=3 187 B18R1.24233 CCOC(=O)C(Oc1ccc(OC)cc1)C(C)=O Amb17621614 [0,2,0,0,0,0|1,0,1]=4 188 B16R2.64 CCOc1nc2ccccc2cc1C=O Amb2605696 [1,0,0,1,0,0|1,0,0]=3 189 B16R2.64 CCOc1nc2ccccc2cc1OC Amb24104408 [1,0,0,1,0,0|2,0,0]=4 190 B16R2.64 CCSc1nc2ccccc2cc1C=O Amb2432681 [1,0,0,1,0,0|1,1,0]=4 191 B16R2.757 CCOC(=O)C1Cc2ccccc2C1=O Amb20623008 [1,0,0,1,0,0|0,0,2]=4 192 B16R2.757 CCOC(=O)C1Nc2ccccc2C1=O Amb17595470 [1,0,0,1,0,0|1,0,1]=4 193 B16R2.757 CCOC(=O)C1Oc2ccccc2C1=O Amb6357844 [1,0,0,1,0,0|1,0,1]=4 194 B16R2.757 CCOC(=O)c1cc2ccccc2n1C Amb1787765 [1,0,0,1,0,0|1,0,0]=3 195 B16R2.757 CCOC(=O)c1cc2cccnc2n1C Amb22494102 [1,0,0,1,0,0|2,0,0]=4 196 B16R2.757 CCOC(=O)c1nc2ccccc2n1C Amb21857358 [1,0,0,1,0,0|2,0,0]=4 197 B16R2.757 CCOC(=O)c1nn2ccccc2c1C Amb35789530 [1,0,0,1,0,0|2,0,0]=4 198 B16R2.757 CCOC(=O)c1oc2ccccc2c1C Amb6355794 [1,0,0,1,0,0|1,0,0]=3 199 B16R2.757 CCOC(=O)c1oc2ccccc2c1N Amb33545723 [1,0,0,1,0,0|2,0,0]=4 200 B16R2.757 CCOC(=O)c1oc2ccccc2c1O Amb22285078 [1,0,0,1,0,0|1,0,1]=4 201 B16R2.757 CCOC(=O)c1sc2ccccc2c1Cl Amb4056859 [1,0,0,1,0,0|2,0,0]=4 202 B16R2.757 CCOC(=O)c1sc2ccccc2c1N Amb2614379 [1,0,0,1,0,0|2,0,0]=4 203 B16R2.757 CCOC(=O)c1sc2ccccc2c1N Amb31291342 [1,0,0,1,0,0|2,0,0]=4 204 B16R2.757 CCOC(=O)c1sc2ccccc2c1O Amb5787406 [1,0,0,1,0,0|1,0,1]=4 205 B16R2.767 CCCC(=O)c1ccc2ccccc2c1 Amb19067000 [1,0,0,1,0,0|1,0,1]=4 206 B16R2.767 CCOC(=N)c1ccc2ccccc2c1 Amb19056471 [1,0,0,1,0,0|1,0,1]=4 207 B16R2.767 CCOC(=N)c1cnc2ccccc2c1 Amb27975542 [1,0,0,1,0,0|2,0,0]=4 208 B16R2.767 CCOC(=O)C1=CNc2ccccc2S1 Amb20283033 [1,0,0,1,0,0|2,0,0]=4 209 B16R2.767 CCOC(=O)C1=Cc2ccccc2OC1 Amb13995995 [1,0,0,1,0,0|0,0,2]=4 210 B16R2.767 CCOC(=O)c1cc2ccccc2cn1 Amb7990136 [1,0,0,1,0,0|1,0,1]=4 211 B16R2.767 CCOC(=O)c1cc2ccccc2nn1 Amb22903248 [1,0,0,1,0,0|2,0,0]=4 212 B16R2.767 CCOC(=O)c1ccc2ccccc2c1 Amb2687909 [1,0,0,1,0,0|0,0,1]=3 213 B16R2.767 CCOC(=O)c1ccc2ccccc2n1 Amb1088900 [1,0,0,1,0,0|1,0,1]=4 214 B16R2.767 CCOC(=O)c1ccc2ccncc2c1 Amb21857738 [1,0,0,1,0,0|1,0,1]=4 215 B16R2.767 CCOC(=O)c1ccc2cnccc2c1 Amb17933379 [1,0,0,1,0,0|1,0,1]=4 216 B16R2.767 CCOC(=O)c1ccc2ncccc2c1 Amb19039734 [1,0,0,1,0,0|1,0,1]=4 217 B16R2.767 CCOC(=O)c1cnc2ccccc2c1 Amb2617152 [1,0,0,1,0,0|1,0,0]=3 218 B16R2.767 CCOC(=O)c1cnc2ccccc2n1 Amb2716288 [1,0,0,1,0,0|2,0,0]=4 219 B16R2.767 CCOC(=O)c1cnc2cccnc2c1 Amb22757404 [1,0,0,1,0,0|2,0,0]=4 220 B16R2.767 CCOC(=O)c1cnc2cnccc2c1 Amb20241506 [1,0,0,1,0,0|2,0,0]=4 221 B16R2.767 CCOC(=O)c1cnc2ncccc2c1 Amb34192837 [1,0,0,1,0,0|2,0,0]=4 222 B16R2.37487 CCN1C(=O)C(C=O)=Cc2ccccc21 Amb19879006 [1,0,0,1,0,0|1,0,0]=3 223 B16R2.3529 CCOc1c(C(=O)O)oc2ccccc12 Amb18655252 [1,0,0,1,0,0|2,0,0]=4 224 B16R2.40082 COc1cc(C(C)=O)cc2ccccc12 Amb32850255 [1,0,0,1,0,0|2,0,0]=4 225 B16R2.1612 CCc1nc2ccccc2cc1C(=O)O Amb18636619 [1,0,0,1,0,0|2,0,0]=4 226 B16R2.1612 CCc1nc2ccccc2cc1C(=O)O Amb33339235 [1,0,0,1,0,0|2,0,0]=4 227 B16R2.1612 COc1cc2ccccc2cc1C(=O)Cl Amb3598174 [1,0,0,1,0,0|2,0,0]=4 228 B16R2.1612 COc1cc2ccccc2cc1C(=O)O Amb1102775 [1,0,0,1,0,0|2,0,0]=4 229 B16R2.1612 COc1cc2ccccc2cc1C(N)=O Amb2283897 [1,0,0,1,0,0|2,0,0]=4 230 B16R2.1612 COc1nc2ccccc2cc1C(=O)O Amb7778339 [1,0,0,1,0,0|2,0,0]=4 231 B16R2.1612 COc1nc2ccccc2cc1C(C)=O Amb33171606 [1,0,0,1,0,0|1,0,0]=3 232 B16R2.5963 CC(=O)c1c(-c2ccccc2)noc1C Amb2726026 [1,0,0,1,0,0|2,0,0]=4 233 B16R2.33941 CCC(=O)c1cc2ccccc2cc1N Amb28197048 [1,0,0,1,0,0|1,0,1]=4 234 B16R2.33941 COC(=O)C1=Cc2ccccc2NC1=O Amb20247345 [1,0,0,1,0,0|1,0,0]=3 235 B16R2.33941 COC(=O)C1=Cc2ccccc2OC1=O Amb18526326 [1,0,0,1,0,0|1,0,0]=3 236 B16R2.33941 COC(=O)c1cc2ccccc2cc1I Amb32410954 [1,0,0,1,0,0|1,0,1]=4 237 B16R2.33941 COC(=O)c1cc2ccccc2cc1N Amb7764617 [1,0,0,1,0,0|1,0,1]=4 238 B16R2.33941 COC(=O)c1cc2ccccc2cc1O Amb6357820 [1,0,0,1,0,0|0,0,2]=4 239 B16R2.33941 COC(=O)c1cc2ccccc2cc1S Amb27611051 [1,0,0,1,0,0|0,1,1]=4 240 B16R2.33941 COC(=O)c1cc2ccccc2nc1C Amb10622659 [1,0,0,1,0,0|1,0,0]=3 241 B16R2.33941 COC(=O)c1cc2ccccc2nc1Cl Amb19373709 [1,0,0,1,0,0|2,0,0]=4 242 B16R2.33941 COC(=O)c1cc2ccccc2nc1N Amb18653823 [1,0,0,1,0,0|2,0,0]=4 243 B16R2.33941 COC(=O)c1nc2ccccc2cc1C Amb22498216 [1,0,0,1,0,0|2,0,0]=4 244 B16R2.33941 COC(=O)c1nc2ccccc2nc1C Amb30982854 [1,0,0,1,0,0|2,0,0]=4 245 B16R2.33941 NCC(=O)C1=Cc2ccccc2OC1=O Amb18531767 [1,0,0,1,0,0|2,0,0]=4 246 B16R2.33941 O=C(CBr)C1=Cc2ccccc2OC1=O Amb18526858 [1,0,0,1,0,0|2,0,0]=4 247 B16R2.83668 CN1C(=O)C(C(=O)O)=Cc2ccccc21 Amb19516776 [1,0,0,1,0,0|2,0,0]=4 248 B16R2.2247 CC1CC(=O)N(c2ccccc2)C(=O)N1 Amb9420812 [0,0,0,1,1,0|2,0,0]=4 249 B16R2.3279 O=C1CCCCC(=O)C1c2ccccc2 Amb17595376 [0,0,0,1,1,0|1,0,1]=4 250 B16R2.29842 CCOC(=O)C1C(=O)Cc2ccccc21 Amb17595433 [0,0,0,1,1,0|0,0,1]=3 251 B16R2.29842 CCOC(=O)C1C(=O)Nc2ccccc21 Amb33481347 [0,0,0,1,1,0|1,0,1]=4 252 B16R2.29842 CCOC(=O)c1c(C)nc2ccccn12 Amb1541117 [0,0,0,1,1,0|2,0,0]=4 253 B16R2.29842 CCOC(=O)c1c(C)nc2ccccn12 Amb17602702 [0,0,0,1,1,0|2,0,0]=4 254 B16R2.29842 CCOC(=O)c1c(C)oc2ccccc12 Amb33623689 [0,0,0,1,1,0|0,0,1]=3 255 B16R2.29842 CCOC(=O)c1c(N)sc2ccccc12 Amb6456018 [0,0,0,1,1,0|1,1,0]=4 256 B16R2.29842 CCOC(=O)c1c2ccccc2nn1C Amb2723784 [0,0,0,1,1,0|2,0,0]=4 257 B18R2.7439 CCOc1nc(-c2ccccc2)c(C(=O)O)s1 Amb2592225 [0,0,0,1,0,1|2,0,0]=4 258 B18R2.124774 CCCC(=O)CC1=Cc2ccccc2OC1=O Amb21913137 [0,0,0,1,0,1|2,0,0]=4 259 B18R2.124774 CCOC(=O)CC1=Nc2ccccc2NC1=O Amb18368786 [0,0,0,1,0,1|2,0,0]=4 260 B18R2.124774 CCOC(=O)Cc1cc2cccnc2nc1C Amb31307763 [0,0,0,1,0,1|2,0,0]=4 261 B18R2.124774 CCOC(=O)Cc1nc2ccccc2nc1C Amb1035733 [0,0,0,1,0,1|2,0,0]=4 262 B18R2.124774 CCOC(=O)\C=C1/Nc2ccccc2NC1=O Amb21952762 [0,0,0,1,0,1|2,0,0]=4 263 B18R2.7385 CCOc1cc(-c2ccccc2)sc1C(=O)O Amb10609095 [0,0,0,1,0,1|2,0,0]=4 264 B18R2.7385 CCOc1oc(-c2ccccc2)nc1C(=O)O Amb133050 [0,0,0,1,0,1|1,0,1]=4 265 B18R2.8107 CCOC(=O)C1=NN(c2ccccc2)CC1=O Amb9833315 [0,0,0,1,0,1|1,0,0]=3 266 B18R2.8107 CCOC(=O)c1cc(-c2ccccc2)nn1C Amb2723866 [0,0,0,1,0,1|2,0,0]=4 267 B18R2.8107 CCOC(=O)c1cc(-c2ccccc2)oc1N Amb4303544 [0,0,0,1,0,1|1,0,1]=4 268 B18R2.8107 CCOC(=O)c1cc(-c2ccccc2)sc1N Amb6335873 [0,0,0,1,0,1|1,1,0]=4 269 B18R2.8107 CCOC(=O)c1cn(-c2ccccc2)cc1O Amb17596338 [0,0,0,1,0,1|0,0,2]=4 270 B18R2.8107 CCOC(=O)c1cn(-c2ccccc2)nc1C Amb19651177 [0,0,0,1,0,1|1,0,0]=3 271 B18R2.8107 CCOC(=O)c1cn(-c2ccccc2)nc1N Amb21963807 [0,0,0,1,0,1|2,0,0]=4 272 B18R2.8107 CCOC(=O)c1nc(-c2ccccc2)oc1C Amb22370495 [0,0,0,1,0,1|0,0,1]=3 273 B18R2.8107 CCOC(=O)c1nc(-c2ccccc2)oc1N Amb18661408 [0,0,0,1,0,1|1,0,1]=4 274 B18R2.8107 CCOC(=O)c1nc(-c2ccccc2)sc1Br Amb16232240 [0,0,0,1,0,1|1,1,0]=4 275 B18R2.8107 CCOC(=O)c1nc(-c2ccccc2)sc1C Amb30982757 [0,0,0,1,0,1|0,1,0]=3 276 B18R2.8107 CCOC(=O)c1nc(-c2ccccc2)sc1N Amb18666299 [0,0,0,1,0,1|1,1,0]=4 277 B18R2.8107 CCOC(=O)c1nc(-c2cccnc2)sc1C Amb30982760 [0,0,0,1,0,1|1,1,0]=4 278 B18R2.8107 CCOC(=O)c1nn(-c2ccccc2)nc1C Amb10789007 [0,0,0,1,0,1|2,0,0]=4 279 B18R2.8107 CCOC(=O)c1oc(-c2ccccc2)cc1N Amb28858071 [0,0,0,1,0,1|1,0,1]=4 280 B18R2.8107 CCOC(=O)c1oc(-c2ccccc2)nc1C Amb7990044 [0,0,0,1,0,1|1,0,0]=3 281 B18R2.8107 CCOC(=O)c1sc(-c2ccccc2)cc1N Amb1106900 [0,0,0,1,0,1|1,0,1]=4 282 B18R2.8107 CCOC(=O)c1sc(-c2ccccc2)cc1O Amb125517 [0,0,0,1,0,1|0,0,2]=4 283 B18R2.8107 CCOC(=O)c1sc(-c2ccccc2)nc1C Amb2411998 [0,0,0,1,0,1|1,0,0]=3 284 B18R2.8107 CCOC(=O)c1sc(-c2ccccc2)nc1O Amb2608706 [0,0,0,1,0,1|1,0,1]=4 285 B18R2.8107 CCOC(=O)c1sc(-c2ccccn2)nc1C Amb2417643 [0,0,0,1,0,1|2,0,0]=4 286 B18R2.8107 CCOC(=O)c1sc(-c2cccnc2)nc1C Amb3428010 [0,0,0,1,0,1|2,0,0]=4 287 B18R2.8107 CCOC(=O)c1sc(-c2ccncc2)nc1C Amb2693886 [0,0,0,1,0,1|2,0,0]=4 288 B18R2.8107 CCO\C(C)=C1\N=C(c2ccccc2)OC1=O Amb19372577 [0,0,0,1,0,1|2,0,0]=4 289 B18R2.8107 CCO\C(O)=C1/SC(c2ccccc2)=CC1=O Amb35746770 [0,0,0,1,0,1|0,0,2]=4 290 B18R2.38168 CC1CC(=O)C(=CNc2ccccc2)C(=O)C1 Amb6752234 [0,0,0,1,0,1|1,0,0]=3 291 B18R2.66773 CN1OC(=O)C(C(=O)O)=C1Cc2ccccc2 Amb18573834 [0,0,0,1,0,1|2,0,0]=4 292 B18R2.230 CCOC(=O)C1=C(c2ccccc2)NC(=O)C1 Amb302814 [0,0,0,1,0,1|1,0,0]=3 293 B18R2.230 CCOC(=O)C1=C(c2ccccc2)NC(=O)N1 Amb31378522 [0,0,0,1,0,1|1,0,0]=3 294 B18R2.230 CCOC(=O)c1cc(C)nn1-c2ccccc2 Amb2773395 [0,0,0,1,0,1|2,0,0]=4 295 B18R2.230 CCOC(=O)c1nc(C)sc1-c2ccccc2 Amb9901225 [0,0,0,1,0,1|0,1,0]=3 296 B18R2.230 CCOC(=O)c1nc(C)sc1-c2ccccn2 Amb19703365 [0,0,0,1,0,1|1,1,0]=4 297 B18R2.230 CCOC(=O)c1nc(C)sc1-c2cccnc2 Amb19703347 [0,0,0,1,0,1|1,1,0]=4 298 B18R2.230 CCOC(=O)c1nc(N)sc1-c2ccccc2 Amb2698540 [0,0,0,1,0,1|1,1,0]=4 299 B18R2.230 CCOC(=O)c1nc(N)sc1-c2ccccc2 Amb32411527 [0,0,0,1,0,1|1,1,0]=4 300 B18R2.230 CCOC(=O)c1nc(S)sc1-c2ccccc2 Amb19703451 [0,0,0,1,0,1|1,1,0]=4 301 B18R2.230 CCOC(=O)c1sc(Br)nc1-c2ccccc2 Amb13777477 [0,0,0,1,0,1|2,0,0]=4 302 B18R2.230 CCOC(=O)c1sc(C)nc1-c2ccccc2 Amb2349810 [0,0,0,1,0,1|1,0,0]=3 303 B18R2.230 CCOC(=O)c1sc(Cl)nc1-c2ccccc2 Amb10873442 [0,0,0,1,0,1|2,0,0]=4 304 B18R2.230 CCOC(=O)c1sc(N)nc1-c2ccccc2 Amb6335311 [0,0,0,1,0,1|2,0,0]=4 305 B18R2.230 CCOC(=O)c1sc(S)nc1-c2ccccc2 Amb9901686 [0,0,0,1,0,1|1,1,0]=4 306 B18R2.81880 CCCC(=O)C1=Cc2cc(Br)ccc2OC1=O Amb19665101 [0,1,0,1,0,0|2,0,0]=4 307 B18R2.81880 CCOC(=O)C1=Cc2cc(Br)ccc2OC1=O Amb18003344 [0,1,0,1,0,0|1,0,0]=3 308 B18R2.81880 CCOC(=O)C1=Cc2cc(Br)cnc2NC1=O Amb19895056 [0,1,0,1,0,0|2,0,0]=4 309 B18R2.81880 CCOC(=O)C1=Cc2cc(O)ccc2OC1=O Amb18009175 [0,1,0,1,0,0|1,0,0]=3 310 B18R2.81880 CCOC(=O)C1=Nc2cc(Br)ccc2NC1=O Amb24073667 [0,1,0,1,0,0|2,0,0]=4 311 B18R2.81880 CCOC(=O)C1=Nc2cc(Cl)ccc2NC1=O Amb24073670 [0,1,0,1,0,0|2,0,0]=4 312 B18R2.81880 CCOC(=O)c1cc2cc(Br)ccc2cc1O Amb21963006 [0,1,0,1,0,0|0,0,2]=4 313 B18R2.81880 CCOC(=O)c1cc2cc(Br)ccc2nc1C Amb1994748 [0,1,0,1,0,0|1,0,0]=3 314 B18R2.81880 CCOC(=O)c1cc2cc(C)ccc2nc1C Amb1994244 [0,1,0,1,0,0|1,0,0]=3 315 B18R2.81880 CCOC(=O)c1cc2cc(Cl)ccc2nc1C Amb1994755 [0,1,0,1,0,0|1,0,0]=3 316 B18R2.81880 CCOC(=O)c1cc2cc(Cl)ccc2nc1Cl Amb30530827 [0,1,0,1,0,0|2,0,0]=4 317 B18R2.81880 CCOC(=O)c1cc2cc(F)ccc2nc1C Amb1994777 [0,1,0,1,0,0|1,0,0]=3 318 B18R2.82072 CCOC(=O)c1cc2cccc(Br)c2nc1C Amb20239567 [0,1,0,1,0,0|1,0,0]=3 319 B18R2.82072 CCOC(=O)c1cc2cccc(C)c2nc1C Amb1994371 [0,1,0,1,0,0|1,0,0]=3 320 B18R2.82072 CCOC(=O)c1cc2cccc(F)c2nc1C Amb20239565 [0,1,0,1,0,0|1,0,0]=3 321 B18R2.273002 CN1OC(=O)C(C(=O)O)=C1c2cccc(Cl)c2 Amb18584573 [0,1,0,1,0,0|2,0,0]=4 322 B18R2.273002 CN1OC(=O)C(C(=O)O)=C1c2cccc(F)c2 Amb18576147 [0,1,0,1,0,0|2,0,0]=4 323 B18R2.273002 Cc1cccc(C2=C(C(=O)O)C(=O)ON2C)c1 Amb18573832 [0,1,0,1,0,0|2,0,0]=4 324 B18R2.8169 CCOC(=O)c1nc2ccccc2cc1CBr Amb23603659 [0,1,0,1,0,0|2,0,0]=4 325 B18R2.80684 CCOC(=O)C1C(=O)COC1c2ccccc2 Amb32417554 [0,1,0,1,0,0|0,0,2]=4 326 B18R2.80684 CCOC(=O)C1C(=O)NCC1c2ccccc2 Amb4006527 [0,1,0,1,0,0|0,0,2]=4 327 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)csc1N Amb17659003 [0,1,0,1,0,0|1,0,1]=4 328 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)noc1Br Amb32721199 [0,1,0,1,0,0|1,0,1]=4 329 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)noc1C Amb16233099 [0,1,0,1,0,0|0,0,1]=3 330 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)noc1Cl Amb20529084 [0,1,0,1,0,0|1,0,1]=4 331 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)noc1N Amb17040684 [0,1,0,1,0,0|1,0,1]=4 332 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)noc1O Amb32721213 [0,1,0,1,0,0|1,0,1]=4 333 B18R2.80684 CCOC(=O)c1c(-c2ccccc2)nsc1C Amb22370856 [0,1,0,1,0,0|0,1,0]=3 334 B18R2.80684 CCOC(=O)c1c(-c2ccncc2)noc1C Amb22411372 [0,1,0,1,0,0|1,0,1]=4 335 B18R2.80684 CCOC(=O)c1c(C)noc1-c2ccccc2 Amb24113830 [0,1,0,1,0,0|0,0,1]=3 336 B18R2.234592 CCn1c(=O)c(C(=O)OC)cc2ccccc21 Amb5722618 [0,1,0,1,0,0|1,0,0]=3 337 B18R2.630054 CCOC(=O)C1=Cc2ccccc2C(=O)N1C Amb32684137 [0,1,0,1,0,0|1,0,0]=3 338 B18R2.284424 CN1OC(=O)C(C(=O)O)=C1c2ccccc2Cl Amb18073284 [0,1,0,1,0,0|2,0,0]=4 339 B18R2.284424 CN1OC(=O)C(C(=O)O)=C1c2ccccc2F Amb18576146 [0,1,0,1,0,0|2,0,0]=4 340 B18R2.284424 Cc1ccccc1C2=C(C(=O)O)C(=O)ON2C Amb18573831 [0,1,0,1,0,0|2,0,0]=4 341 B18R2.631601 CCOC(=O)C1=Cc2c(C)ccnc2NC1=O Amb33875721 [0,1,0,1,0,0|2,0,0]=4 342 B18R2.631601 CCOC(=O)C1=Cc2c(Cl)cccc2NC1=O Amb20247062 [0,1,0,1,0,0|1,0,0]=3 343 B18R2.631601 CCOC(=O)C1=Cc2c(Cl)cccc2OC1=O Amb22750272 [0,1,0,1,0,0|1,0,0]=3 344 B18R2.24266 CCN1C(=O)C(C(C)=O)=C(O)c2ccccc21 Amb20651452 [0,1,0,1,0,0|1,0,0]=3 345 B18R2.72556 CC(=O)C(C(=O)c1ccccc1)=C2SCCS2 Amb16228944 [0,1,0,1,0,0|0,2,0]=4 346 B18R2.72556 CC(=O)\C(C(=O)c1ccccc1)=C2\CCCN2 Amb32426044 [0,1,0,1,0,0|2,0,0]=4 347 B18R2.82229 CCOC(=O)C1=C(N)c2ccccc2S1(=O)=O Amb1102542 [0,1,0,1,0,0|2,0,0]=4 348 B18R2.82315 CCOC(=O)C1=C(Cl)c2ccccc2NC1=O Amb20027920 [0,1,0,1,0,0|1,0,0]=3 349 B18R2.82315 CCOC(=O)C1=C(N)c2ccccc2NC1=O Amb23559881 [0,1,0,1,0,0|1,0,0]=3 350 B18R2.82315 CCOC(=O)C1=C(O)c2ccccc2NC1=O Amb19816279 [0,1,0,1,0,0|1,0,0]=3 351 B18R2.82315 CCOC(=O)C1=C(O)c2ccccc2OC1=O Amb18538363 [0,1,0,1,0,0|1,0,0]=3 352 B18R2.82315 CCOC(=O)C1=C(O)c2cccnc2NC1=O Amb19891261 [0,1,0,1,0,0|2,0,0]=4 353 B18R2.82315 CCOC(=O)c1c(C)nc2ccccc2c1C Amb2300395 [0,1,0,1,0,0|1,0,0]=3 354 B18R2.82315 CCOC(=O)c1c(C)nc2ccccc2c1N Amb9870448 [0,1,0,1,0,0|1,0,0]=3 355 B18R2.82315 CCOC(=O)c1c(C)nc2ccccc2c1O Amb1220353 [0,1,0,1,0,0|1,0,0]=3 356 B18R2.82315 CCOC(=O)c1c(Cl)nc2ccccc2c1C Amb20622347 [0,1,0,1,0,0|2,0,0]=4 357 B18R2.82315 CCOC(=O)c1c(Cl)nc2ccccc2c1Cl Amb534192 [0,1,0,1,0,0|2,0,0]=4 358 B18R2.82315 CCOC(=O)c1c(Cl)nc2ccccc2c1N Amb32424335 [0,1,0,1,0,0|2,0,0]=4 359 B18R2.82315 CCOC(=O)c1c(O)cc2ccccc2c1O Amb2459249 [0,1,0,1,0,0|0,0,2]=4 360 B18R2.81826 CCCC(=O)C1=Cc2ccc(O)cc2OC1=O Amb20285985 [0,1,0,1,0,0|2,0,0]=4 361 B18R2.81826 CCOC(=O)C1=Cc2ccc(Br)cc2OC1=O Amb33719443 [0,1,0,1,0,0|1,0,0]=3 362 B18R2.81826 CCOC(=O)C1=Cc2ccc(F)cc2OC1=O Amb33719442 [0,1,0,1,0,0|1,0,0]=3 363 B18R2.81826 CCOC(=O)C1=Cc2ccc(O)cc2OC1=O Amb19524973 [0,1,0,1,0,0|1,0,0]=3 364 B18R2.81826 CCOC(=O)C1=Nc2ccc(Cl)cc2NC1=O Amb24073665 [0,1,0,1,0,0|2,0,0]=4 365 B18R2.81826 CCOC(=O)c1cc2ccc(Br)cc2nc1C Amb1994795 [0,1,0,1,0,0|1,0,0]=3 366 B18R2.81826 CCOC(=O)c1cc2ccc(C)cc2nc1C Amb1994245 [0,1,0,1,0,0|1,0,0]=3 367 B18R2.81826 CCOC(=O)c1cc2ccc(Cl)cc2nc1C Amb1994181 [0,1,0,1,0,0|1,0,0]=3 368 B18R2.234662 CCN1C(=O)C(C(=O)O)=Cc2ccc(C)cc21 Amb20414196 [0,1,0,1,0,0|2,0,0]=4 369 B18R2.684520 CN1OC(=O)C(C(=O)O)=C1c2ccc(Cl)cc2 Amb18584574 [0,1,0,1,0,0|2,0,0]=4 370 B18R2.684520 CN1OC(=O)C(C(=O)O)=C1c2ccc(F)cc2 Amb18576148 [0,1,0,1,0,0|2,0,0]=4 371 B18R2.684520 Cc1ccc(C2=C(C(=O)O)C(=O)ON2C)cc1 Amb18573833 [0,1,0,1,0,0|2,0,0]=4 372 B18R2.2938 CCN1OC(=O)C(C(=O)O)=C1c2ccccc2 Amb18563026 [0,1,0,1,0,0|1,0,0]=3 373 B18R2.8949 CCCOc1nc2ccccc2cc1C(=O)O Amb8874897 [0,1,0,1,0,0|2,0,0]=4 374 B18R2.123786 C#CCOC(=O)C1=Cc2ccccc2OC1=O Amb32416683 [0,1,0,1,0,0|1,0,1]=4 375 B18R2.123786 O=C(NCCO)C1=Cc2ccccc2OC1=O Amb18011993 [0,1,0,1,0,0|2,0,0]=4 376 B18R2.32565 CC(C)N1C(=O)C(C(=O)O)=Cc2ccccc21 Amb19372950 [0,1,0,1,0,0|2,0,0]=4 377 B18R2.61969 CC(C)OC(=O)C1=Cc2ccccc2OC1=O Amb18003352 [0,1,0,1,0,0|1,0,0]=3 378 B18R2.71144 CC(C)Oc1cc2ccccc2cc1C(=O)O Amb6374207 [0,1,0,1,0,0|2,0,0]=4 379 B18R2.71144 CC(C)Oc1nc2ccccc2cc1C(=O)O Amb24113705 [0,1,0,1,0,0|2,0,0]=4 380 B18R3.2571370 O=C(O)C1=Cc2cccc3c2N(CC3)C1=O Amb19882345 [0,0,0,2,0,0|2,0,0]=4 381 B18R3.2571370 O=C(O)c1cc2cccc3c2n(c1=O)CC3 Amb2607065 [0,0,0,2,0,0|2,0,0]=4 382 B14R1.604 CCOC(=O)C(NC)c1ccccc1 Amb19079319 [1,0,0,0,1,0|1,0,1]=4 383 B14R1.2984 CN\C(C)=C(/C(C)=O)c1ccccc1 Amb27747093 [1,0,0,0,1,0|2,0,0]=4 384 B14R1.2984 COC(=O)C(C(=O)O)c1ccccc1 Amb2747305 [1,0,0,0,1,0|1,0,1]=4 385 B14R1.2984 COC(=O)C(C(C)=O)c1ccccc1 Amb18565064 [1,0,0,0,1,0|0,0,1]=3 386 B14R1.2984 COC(=O)C(C(C)=O)c1ccccn1 Amb18565192 [1,0,0,0,1,0|1,0,1]=4 387 B14R1.2984 COC(=O)C(C(C)=O)c1cccnc1 Amb18565193 [1,0,0,0,1,0|1,0,1]=4 388 B14R1.2984 COC(=O)C(C(C)=O)c1ccncc1 Amb18565194 [1,0,0,0,1,0|1,0,1]=4 389 B14R1.2984 COC(=O)\C(=C(\C)N)c1ccccc1 Amb25202120 [1,0,0,0,1,0|1,0,0]=3 390 B16R1.740 CCOC(=O)C(C=O)OCc1ccccc1 Amb27972736 [1,0,0,0,0,1|0,0,2]=4 391 B16R1.936 CCOC(=O)\C=C(\CC)Cc1ccccc1 Amb33493090 [1,0,0,0,0,1|0,0,2]=4 392 B16R1.5825 CC(=O)N\C(=C/c1ccccc1)C(=O)NN Amb33869827 [1,0,0,0,0,1|2,0,0]=4 393 B16R1.5825 COC(=O)C(Cc1ccccc1)NC(C)=O Amb2609065 [1,0,0,0,0,1|0,0,2]=4 394 B16R1.5825 COC(=O)[C@@H](Cc1ccccc1)NC(C)=O Amb33823181 [1,0,0,0,0,1|0,0,2]=4 395 B16R1.5825 COC(=O)[C@H](Cc1ccccc1)NC(C)=O Amb17621818 [1,0,0,0,0,1|0,0,2]=4 396 B16R1.5825 COC(=O)\C(=C/c1cccnc1)CC(=O)O Amb33716691 [1,0,0,0,0,1|2,0,0]=4 397 B16R1.5825 COC(=O)\C(=C\c1ccccc1)NC(C)=O Amb22001044 [1,0,0,0,0,1|0,0,0]=2 398 B16R1.6737 COC(=O)\C(=C/Nc1ccccn1)C(=O)O Amb2613104 [1,0,0,0,0,1|2,0,0]=4 399 B16R1.14044 CCOC(=O)C(CC(=O)O)c1ccccc1 Amb6407059 [0,0,0,0,1,1|1,0,1]=4 400 B16R1.15562 CCOC(=O)\C=C(/c1ccccc1)C(C)C Amb33493136 [0,0,0,0,1,1|1,0,1]=4 401 B18R1.5636 CCOC(=O)CN(CC(C)=O)Cc1ccccc1 Amb29838166 [0,0,0,0,0,2|1,0,1]=4 402 B18R1.214523 CCOC(=O)\C(=N\OCc1ccccc1)C(C)=O Amb6383958 [0,0,0,0,0,2|0,0,1]=3