0 B21R3.7798 CC1=CC(C(=O)O1)(c2ccccc2)c3ccccc3 Amb22479767 [0,0,0,0,0,0|3,0,0]=3 1 B21R3.7798 CC1CC(C(=O)O1)(c2ccccc2)c3ccccc3 Amb22444580 [0,0,0,0,0,0|3,0,1]=4 2 B21R3.7798 C[C@@H]1NC(=O)OC1(c2ccccc2)c3ccccc3 Amb22336480 [0,0,0,0,0,0|2,0,1]=3 3 B21R3.7798 C[C@H]1NC(=O)OC1(c2ccccc2)c3ccccc3 Amb22351572 [0,0,0,0,0,0|2,0,1]=3 4 B21R3.7798 N=C1NC(=O)C(O1)(c2ccccc2)c3ccccc3 Amb22487331 [0,0,0,0,0,0|2,0,0]=2 5 B21R3.7798 O=C1NC(=N)NC1(c2ccccc2)c3ccccc3 Amb1797586 [0,0,0,0,0,0|1,0,0]=1 6 B21R3.7798 O=C1NC(=NC1(c2ccccc2)c3ccccc3)N Amb1101130 [0,0,0,0,0,0|1,0,1]=2 7 B21R3.7798 O=C1NC(=NC1(c2ccccc2)c3ccccc3)O Amb1251769 [0,0,0,0,0,0|0,0,2]=2 8 B21R3.7798 O=C1NC(=O)C(N1)(c2ccccc2)c3ccccc3 Amb20239420 [0,0,0,0,0,0|0,0,0]=0 9 B21R3.7798 O=C1NC(=O)[N-]C1(c2ccccc2)c3ccccc3 Amb20246446 [0,0,0,0,0,0|0,0,1]=1 10 B21R3.7798 O=C1[N-]C(=O)NC1(c2ccccc2)c3ccccc3 Amb22524343 [0,0,0,0,0,0|0,0,1]=1 11 B21R3.7798 OC1=NC(=NC1(c2ccccc2)c3ccccc3)O Amb16209132 [0,0,0,0,0,0|0,0,4]=4 12 B21R3.7798 [O-]C=1NC(C(=O)N1)(c2ccccc2)c3ccccc3 Amb22395928 [0,0,0,0,0,0|0,0,2]=2 13 B22R3.236145 CC1CC(C(=O)N1C)(c2ccccc2)c3ccccc3 Amb17613254 [0,1,0,0,0,0|2,0,1]=4 14 B22R3.236145 CN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3 Amb10555284 [0,1,0,0,0,0|0,0,0]=1 15 B22R3.236145 CN1C(=S)NC(C1=O)(c2ccccc2)c3ccccc3 Amb10555279 [0,1,0,0,0,0|0,1,0]=2 16 B22R3.335741 CC1(C)NC(=O)C(O1)(c2ccccc2)c3ccccc3 Amb22472151 [0,1,0,0,0,0|2,0,1]=4 17 B22R3.5441013 Oc1cccc(c1)C2(NC(=O)NC2=O)c3ccccc3 Amb17615703 [0,1,0,0,0,0|0,0,0]=1 18 B22R3.15235942 O=C1NC(=O)C(N1)(c2ccc(cc2)O)c3ccccc3 Amb1125953 [0,1,0,0,0,0|0,0,0]=1 19 B20R2.14082 BrCCC(=O)NC(c1ccccc1)c2ccccc2 Amb17322945 [0,0,1,0,0,0|2,0,1]=4 20 B20R2.14082 CCCC(=O)NC(c1ccccc1)c2ccccc2 Amb1871518 [0,0,1,0,0,0|2,0,1]=4 21 B20R2.14082 CCNC(=O)NC(c1cc[n]cc1)c2ccccc2 Amb21526687 [0,0,1,0,0,0|2,0,1]=4 22 B20R2.14082 CCNC(=O)NC(c1ccccn1)c2ccccc2 Amb11224245 [0,0,1,0,0,0|2,0,1]=4 23 B20R2.14082 CCOC(=O)NC(c1ccccc1)c2ccccc2 Amb1260594 [0,0,1,0,0,0|2,0,1]=4 24 B20R2.14082 CNCC(=O)NC(c1ccccc1)c2ccccc2 Amb21953931 [0,0,1,0,0,0|3,0,0]=4 25 B20R2.14082 CSCC(=O)NC(c1ccccc1)c2ccccc2 Amb142276 [0,0,1,0,0,0|3,0,0]=4 26 B20R2.14082 NCCC(=O)NC(c1ccccc1)c2ccccc2 Amb19134551 [0,0,1,0,0,0|2,0,1]=4 27 B20R2.14082 O=C=NC(=O)CC(c1ccccc1)c2ccccc2 Amb17262083 [0,0,1,0,0,0|1,0,2]=4 28 B20R2.174637 CN(C(c1ccccc1)c2ccccc2)CC(=O)N Amb15851690 [0,0,1,0,0,0|3,0,0]=4 29 B20R2.174637 NC(=O)CS(O)C(c1ccccc1)c2ccccc2 Amb19133331 [0,0,1,0,0,0|2,0,1]=4 30 B20R2.174637 O=C(N(c1ccccc1)c2ccccc2)CC(=O)C Amb17596981 [0,0,1,0,0,0|3,0,0]=4 31 B20R2.174637 OC(=O)C[S@@](=O)C(c1ccccc1)c2ccccc2 Amb17618042 [0,0,1,0,0,0|3,0,0]=4 32 B20R2.174637 OC(=O)C[S@](=O)C(c1ccccc1)c2ccccc2 Amb19133329 [0,0,1,0,0,0|3,0,0]=4 33 B22R4.8403251 O=C1NC(=O)C2(N1)c3ccccc3c4c2cccc4 Amb1138676 [0,0,0,1,0,0|0,0,0]=1 34 B22R3.12644 O=C1CC(=O)C(CC1)(c2ccccc2)c3ccccc3 Amb22489627 [0,0,0,0,0,1|2,0,0]=3 35 B22R3.235742 N=C1NC(=O)C(Cc2ccccc2)(O1)c3ccccc3 Amb22485544 [0,0,0,0,0,1|2,0,0]=3 36 B22R3.235742 NC=1NC(Cc2ccccc2)(C(=O)N1)c3ccccc3 Amb20672596 [0,0,0,0,0,1|1,0,1]=3 37 B22R3.235742 O=C1NC(=O)C(N1)(Cc2ccccc2)c3ccccc3 Amb1543464 [0,0,0,0,0,1|0,0,0]=1 38 B22R3.235742 O=C1NC(=O)NC1(Cc2ccccc2)c3c[n]ccc3 Amb24081370 [0,0,0,0,0,1|1,0,0]=2 39 B19R2.13518 NC(=O)CC(O)(c1ccccc1)c2ccccc2 Amb22462085 [1,0,1,0,0,0|1,0,1]=4 40 B19R2.9813 O=C=NC(=O)C(c1ccccc1)c2ccccc2 Amb17253521 [1,0,1,0,0,0|0,0,2]=4 41 B19R2.12728 NNC(=O)C(c1ccccc1)(c2ccccc2)O Amb1807630 [1,0,1,0,0,0|2,0,0]=4 42 B19R2.12918 BrCC(=O)NC(c1ccccc1)c2ccccc2 Amb17323569 [1,0,1,0,0,0|1,0,1]=4 43 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccc2 Amb1233545 [1,0,1,0,0,0|1,0,1]=4 44 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccc2 Amb11258713 [1,0,1,0,0,0|0,0,1]=3 45 B19R2.12918 ClCC(=O)NC(c1ccccc1)c2ccccc2 Amb1195945 [1,0,1,0,0,0|1,0,1]=4 46 B19R2.12918 NCC(=O)NC(c1ccccc1)c2ccccc2 Amb19134550 [1,0,1,0,0,0|1,0,1]=4 47 B19R2.12918 NNC(=O)NN(c1ccccc1)c2ccccc2 Amb17772318 [1,0,1,0,0,0|2,0,0]=4 48 B19R2.12918 OCC(=O)NC(c1ccccc1)c2ccccc2 Amb22802712 [1,0,1,0,0,0|0,0,2]=4 49 B19R2.12918 ONC(=O)CC(c1ccccc1)c2ccccc2 Amb17255589 [1,0,1,0,0,0|1,0,1]=4 50 B19R2.13577 NC(=O)COC(c1ccccc1)c2ccccc2 Amb11229706 [1,0,1,0,0,0|2,0,0]=4 51 B21R2.4836257 OC(=O)C(c1ccccc1)(c2ccccc2)CC(=O)O Amb10571872 [0,1,1,0,0,0|2,0,0]=4 52 B21R2.4836257 OC(=O)C(c1ccccc1)(c2ccccc2)OC(=O)C Amb2583172 [0,1,1,0,0,0|2,0,0]=4 53 B21R2.25778 CCCNC(=O)NC(c1ccccc1)c2ccccc2 Amb2573315 [0,1,1,0,0,0|1,0,1]=4 54 B21R2.25778 O=C(NCCBr)NC(c1ccccc1)c2ccccc2 Amb24063947 [0,1,1,0,0,0|1,0,1]=4 55 B21R2.97772 CC(NC(=O)NC(c1ccccc1)c2ccccc2)C Amb1203712 [0,1,1,0,0,0|1,0,1]=4 56 B21R2.97772 NC(=N)CC(=O)NC(c1ccccc1)c2ccccc2 Amb22913407 [0,1,1,0,0,0|2,0,0]=4 57 B21R2.257738 O=C(C(c1ccccc1)c2ccccc2)NS(=O)(=O)C Amb15718264 [0,1,1,0,0,0|2,0,0]=4 58 B21R2.401059 NC(=O)CS(=O)(=O)C(c1ccccc1)c2ccccc2 Amb1893640 [0,1,1,0,0,0|2,0,0]=4 59 B21R3.7675 OC1=CC(OC1=O)(c2ccccc2)c3ccccc3 Amb17844047 [1,1,0,0,0,0|2,0,0]=4 60 B21R3.239162 O=C1NC(C1(C)C)(c2ccccc2)c3ccccc3 Amb2387471 [0,1,0,0,1,0|1,0,1]=4 61 B23R3.7707214 Cc1ccc(CC2(NC(N)=NC2=O)c3ccccc3)cc1 Amb20672599 [0,1,0,0,0,1|1,0,1]=4 62 B23R3.7707214 NC=1NC(Cc2ccc(Cl)cc2)(C(=O)N1)c3ccccc3 Amb20672587 [0,1,0,0,0,1|1,0,1]=4 63 B23R3.7707214 NC=1NC(Cc2ccc(F)cc2)(C(=O)N1)c3ccccc3 Amb20672589 [0,1,0,0,0,1|1,0,1]=4 64 B23R3.7916386 NC=1NC(Cc2ccccc2)(C(=O)N1)c3cccc(Cl)c3 Amb20672278 [0,1,0,0,0,1|1,0,1]=4 65 B23R3.7929030 NC=1NC(Cc2cc(F)ccc2)(C(=O)N1)c3ccccc3 Amb20672608 [0,1,0,0,0,1|1,0,1]=4 66 B23R3.9987400 NC=1NC(Cc2ccccc2F)(C(=O)N1)c3ccccc3 Amb20672601 [0,1,0,0,0,1|1,0,1]=4 67 B23R3.24453576 Cc1ccc(cc1)C2(Cc3ccccc3)NC(N)=NC2=O Amb20672420 [0,1,0,0,0,1|1,0,1]=4 68 B23R3.24453576 NC=1NC(Cc2ccccc2)(C(=O)N1)c3ccc(Br)cc3 Amb20672348 [0,1,0,0,0,1|1,0,1]=4 69 B23R3.24453576 NC=1NC(Cc2ccccc2)(C(=O)N1)c3ccc(Cl)cc3 Amb20672662 [0,1,0,0,0,1|1,0,1]=4 70 B23R3.24453576 NC=1NC(Cc2ccccc2)(C(=O)N1)c3ccc(F)cc3 Amb20672311 [0,1,0,0,0,1|1,0,1]=4 71 B23R3.721 O=C1C=C(C=O)OC(N1)(c2ccccc2)c3ccccc3 Amb22486292 [0,1,0,0,0,1|1,0,0]=3 72 B23R3.52380 N#C\N=C/1\NC(=O)C(N1)(c2ccccc2)c3ccccc3 Amb1780379 [0,2,0,0,0,0|1,0,0]=3 73 B23R3.290624 CN(C)C=1NC(C(=O)N1)(c2ccccc2)c3ccccc3 Amb22453090 [0,2,0,0,0,0|1,0,1]=4 74 B23R3.2085792 CCN1C(=O)NC(C1=O)(c2ccccc2)c3ccccc3 Amb10812159 [0,2,0,0,0,0|0,0,0]=2 75 B23R3.24524861 O=C1NC(=O)C(N1)(c2ccccc2)c3ccc(c(c3)C)C Amb2333782 [0,2,0,0,0,0|0,0,0]=2 76 B23R3.24453577 Cc1ccc(cc1)C2(NC(=O)NC2=O)c3ccc(O)cc3 Amb24097680 [0,2,0,0,0,0|0,0,0]=2 77 B23R3.24453577 O=C1NC(=O)NC1(c2ccc(cc2)C)c3ccc(cc3)C Amb2253638 [0,2,0,0,0,0|0,0,0]=2 78 B23R3.24453577 O=C1NC(=O)NC1(c2ccc(cc2)F)c3ccc(cc3)F Amb2371123 [0,2,0,0,0,0|0,0,0]=2 79 B21R3.7545 Nc1[nH]c([n][n]1)C(c2ccccc2)c3ccccc3 Amb17659118 [0,0,1,1,0,0|2,0,0]=4 80 B21R3.7545 Nc1nnc([nH]1)C(c2ccccc2)c3ccccc3 Amb2236501 [0,0,1,1,0,0|2,0,0]=4 81 B21R3.8240968 C=CCC1(C(=O)Nc2ccccc12)c3ccccc3 Amb22473168 [0,0,1,1,0,0|2,0,0]=4 82 B21R3.8240968 O=C1Nc2ccccc2C1(CC=O)c3ccccc3 Amb22444550 [0,0,1,1,0,0|1,0,0]=3 83 B21R3.29589416 O=C1CC(c2c1cccc2)(C(=O)O)c3ccccc3 Amb2440336 [0,0,1,1,0,0|2,0,0]=4 84 B21R3.29589416 O=C1OC(c2c1cccc2)(C(=O)O)c3ccccc3 Amb17596996 [0,0,1,1,0,0|2,0,0]=4 85 B19R2.113616 NC(=O)S(=O)C(c1ccccc1)c2ccccc2 Amb20247300 [0,0,1,0,1,0|1,0,0]=3 86 B19R2.113616 O=C(N(c1ccccc1)c2ccccc2)C(=O)O Amb2170598 [0,0,1,0,1,0|2,0,0]=4 87 B19R3.4061 O=C1SCC1(c2ccccc2)c3ccccc3 Amb17675277 [1,0,0,0,1,0|1,0,1]=4 88 B19R3.2141314 O=C1NC(=O)C(N1)(c2cccs2)c3cccs3 Amb2333039 [0,0,0,0,2,0|2,0,0]=4 89 B21R2.402445 O=C(N(c1ccccc1)c2ccccc2)CCC(=O)N Amb1836124 [0,0,1,0,0,1|2,0,0]=4 90 B23R3.130971 O=C1NC(=O)C(CCc2ccccc2)(N1)c3ccccc3 Amb22466869 [0,0,0,0,0,2|0,0,0]=2 91 B23R3.131098 O=C1NC(=O)NC1(Cc2ccccc2)Cc3ccccc3 Amb1543430 [0,0,0,0,0,2|0,0,0]=2