0 B14R2.781 CC(=O)C1=CC2=C(C=C1)OCCO2 BB0268500 [0,0,0,0,0,0|2,0,2]=4 1 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 BB0269895 [0,0,0,0,0,0|2,0,1]=3 2 B14R2.781 O=C(O)C1=CC2=NC=CN=C2C=C1 BB0256588 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 BB0270065 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 BB0257504 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.57 O=CC1=CC2=C(C=CC=C2)OC1 BB0255285 [1,0,0,0,0,0|1,0,1]=3 6 B13R2.57 O=CC1=CC2=NC=CN=C2C=C1 BB0216343 [1,0,0,0,0,0|2,0,0]=3 7 B13R2.57 O=CC1=NC2=NC=CC=C2C=C1 BB0260494 [1,0,0,0,0,0|2,0,0]=3 8 B15R2.627 NC1=C(C(=O)O)C=NC2=CC=CC=C21 BB0222277 [0,1,0,0,0,0|2,0,0]=3 9 B15R2.627 O=C(O)C1=C(O)C2=CC=CC=C2N=C1 BB0221686 [0,1,0,0,0,0|2,0,0]=3 10 B15R2.627 O=C(O)C1=CN=C2C=CC=CN2C1=O BB0219114 [0,1,0,0,0,0|3,0,0]=4 11 B15R2.984 O=C(O)C1=CC2=CC=CN=C2NC1=O BB0270372 [0,1,0,0,0,0|3,0,0]=4 12 B15R2.1601 CN[C@@H](C)C1=CC2=CC=CC=C2C=C1 BB0293274 [0,1,0,0,0,0|1,0,1]=3 13 B15R2.1601 C\C(=N/O)C1=CC2=CC=CC=C2C=C1 BB0277124 [0,1,0,0,0,0|0,0,1]=2 14 B15R2.7174 O=C(O)C1=CC2=C(C=CC(Cl)=C2)OC1 BB0270239 [0,1,0,0,0,0|2,0,1]=4 15 B15R2.13598 O=C(O)C1=CC=C2C(Cl)=CC=NC2=C1 BB0267319 [0,1,0,0,0,0|2,0,0]=3 16 B15R2.14951 O=[N+]([O-])C1=CC2=CC=CN=C2C(O)=C1 BB0269877 [0,1,0,0,0,0|3,0,0]=4 17 B13R1.74 C=CCOC1=CC=C(C(=O)O)C=C1 BB0287026 [0,0,1,0,0,0|2,0,1]=4 18 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 BB0270551 [0,0,0,0,1,0|3,0,0]=4 19 B13R2.72 O=C(O)C1=NC=C2C=CC=CN21 BB0262471 [0,0,0,0,1,0|3,0,0]=4 20 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 BB0216340 [0,0,0,0,1,0|3,0,0]=4 21 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=CS2 BB0270474 [0,0,0,0,1,0|3,0,0]=4 22 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=N2 BB0258867 [0,0,0,0,1,0|3,0,0]=4 23 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)N1 BB0266633 [0,0,0,0,1,0|2,0,0]=3 24 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)S1 BB0269958 [0,0,0,0,1,0|3,0,0]=4 25 B13R2.435 O=C(Cl)C1=NC2=C(C=CC=C2)N1 BB0265985 [0,0,0,0,1,0|3,0,0]=4 26 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)O1 BB0244005 [0,0,0,0,1,0|2,0,0]=3 27 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)N1 BB0220676 [0,0,0,0,1,0|3,0,0]=4 28 B13R2.435 O=C([O-])C1=NC2=C(C=CC=C2)S1 BB0270420 [0,0,0,0,1,0|3,0,0]=4 29 B15R2.1237 O=C(O)C1=CC2=C(C=CC=C2)OC=C1 BB0270568 [0,0,0,0,0,1|1,0,0]=2 30 B12R1.125 CC(=O)\C=C\C1=C(O)C=CC=C1 BB0269827 [1,0,1,0,0,0|1,0,0]=3 31 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 BB0281883 [1,0,1,0,0,0|2,0,0]=4 32 B12R2.24 BrC1=CC2=CC=NC=C2C=C1 BB0268383 [2,0,0,0,0,0|2,0,0]=4 33 B12R2.24 BrC1=CC2=CN=CC=C2C=C1 BB0261827 [2,0,0,0,0,0|2,0,0]=4 34 B12R2.24 IC1=CC2=CC=CC=C2C=C1 BB0220370 [2,0,0,0,0,0|1,0,0]=3 35 B12R2.24 NC1=CC2=CC=CC=C2C=C1 BB0266016 [2,0,0,0,0,0|1,0,0]=3 36 B12R2.24 NC1=CC2=CC=CC=C2N=C1 BB0237444 [2,0,0,0,0,0|2,0,0]=4 37 B12R2.24 OC1=CC2=NC=CC=C2C=C1 BB0270513 [2,0,0,0,0,0|1,0,1]=4 38 B14R2.112 NNCC1=CC2=CC=CC=C2C=C1 BB0219974 [1,1,0,0,0,0|1,0,1]=4 39 B14R2.112 OCCC1=NC2=CC=CC=C2C=C1 BB0268375 [1,1,0,0,0,0|1,0,1]=4 40 B14R2.112 O\N=C\C1=CC2=CC=CC=C2C=C1 BB0273384 [1,1,0,0,0,0|0,0,1]=3 41 B14R2.134 O=CC1=CC2=C(C=CC(Cl)=C2)OC1 BB0270237 [1,1,0,0,0,0|1,0,1]=4 42 B14R2.142 COC1=CC=C2N=CC=C(Cl)C2=C1 BB0270512 [1,1,0,0,0,0|2,0,0]=4 43 B14R2.1019 CCC1=NC2=CC=CC=C2C(N)=C1 BB0263799 [1,1,0,0,0,0|1,0,1]=4 44 B14R2.1019 CCC1=NC2=CC=CC=C2C(O)=C1 BB0263773 [1,1,0,0,0,0|1,0,1]=4 45 B14R2.1019 COC1=CC2=CC=CN=C2C(N)=C1 BB0270011 [1,1,0,0,0,0|2,0,0]=4 46 B14R2.1128 O=CC1=CC2=C(C=CC=C2)NC1=O BB0269817 [1,1,0,0,0,0|1,0,0]=3 47 B14R2.1128 O=CC1=CC2=CC=CC=C2N=C1Cl BB0258201 [1,1,0,0,0,0|1,0,0]=3 48 B14R2.25733 CC(=O)C1=CN(C)C2=C1C=CC=C2 BB0217944 [0,1,0,0,1,0|1,0,0]=3 49 B14R2.450 NC(=O)C1=C(Cl)C2=C(C=CC=C2)S1 BB0244002 [0,1,0,0,1,0|2,0,0]=4 50 B14R2.972 NNC(=O)C1=CC2=C(C=CC=C2)O1 BB0217244 [0,1,0,0,1,0|2,0,0]=4 51 B14R2.972 O=C(CBr)C1=CC2=C(C=CC=C2)O1 BB0237134 [0,1,0,0,1,0|1,0,0]=3 52 B14R2.4529 NC(=O)C1=CC2=C(C=CC(F)=C2)N1 BB0259118 [0,1,0,0,1,0|2,0,0]=4 53 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)O1 BB0270558 [0,1,0,0,1,0|2,0,0]=4 54 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)O1 BB0270263 [0,1,0,0,1,0|2,0,0]=4 55 B14R2.7969 CC1=CC=CC2=C1NC(C(=O)O)=C2 BB0220019 [0,1,0,0,1,0|2,0,0]=4 56 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2O)N1 BB0270427 [0,1,0,0,1,0|2,0,0]=4 57 B16R2.6284 N[C@@H](C(=O)O)C1=CC2=CC=CC=C2C=C1 BB0249667 [0,1,0,0,0,1|1,0,0]=3 58 B16R2.12044 CC(=O)C1=CN=C2C=CC(Cl)=CC2=C1O BB0222280 [0,2,0,0,0,0|1,0,0]=3 59 B16R2.12044 CC1=CC=C2N=CC(C(=O)O)=C(N)C2=C1 BB0221365 [0,2,0,0,0,0|2,0,0]=4 60 B16R2.12044 CC1=CC=C2N=CC(C(=O)O)=C(O)C2=C1 BB0221364 [0,2,0,0,0,0|2,0,0]=4 61 B16R2.12044 NC1=C2C=C(Cl)C=CC2=NC=C1C(=O)O BB0218955 [0,2,0,0,0,0|2,0,0]=4 62 B16R2.12044 NC1=C2C=C(F)C=CC2=NC=C1C(=O)O BB0222177 [0,2,0,0,0,0|2,0,0]=4 63 B16R2.12044 O=C(O)C1=CN=C2C=CC(F)=CC2=C1O BB0221940 [0,2,0,0,0,0|2,0,0]=4 64 B16R2.22861 NC1=C2C=CC=C(Cl)C2=NC=C1C(=O)O BB0218951 [0,2,0,0,0,0|2,0,0]=4 65 B16R2.22861 NC1=C2C=CC=C(F)C2=NC=C1C(=O)O BB0218952 [0,2,0,0,0,0|2,0,0]=4 66 B16R2.22861 O=C(O)C1=CN=C2C(F)=CC=CC2=C1O BB0221937 [0,2,0,0,0,0|2,0,0]=4 67 B16R2.23331 CN1C=C(C(=O)O)C(=O)C2=C1C=CC=C2 BB0221581 [0,2,0,0,0,0|2,0,0]=4 68 B16R2.23372 CC1=C(C(=O)O)C(=O)OC2=C1C=CC=C2 BB0270509 [0,2,0,0,0,0|2,0,0]=4 69 B16R2.1612 COC1=CC2=CC=CC=C2C=C1C(=O)O BB0243968 [0,2,0,0,0,0|1,0,0]=3 70 B16R2.23521 CC1=C(C(=O)O)C=C2C=C(F)C=CC2=N1 BB0258014 [0,2,0,0,0,0|2,0,0]=4 71 B16R2.33941 COC(=O)C1=CC2=CC=CC=C2N=C1Cl BB0257369 [0,2,0,0,0,0|1,0,0]=3 72 B16R2.767 C[C@H](NC=O)C1=CC2=CC=CC=C2C=C1 BB0293280 [0,2,0,0,0,0|0,0,1]=3 73 B16R2.26112 CC1=CC(N)=C2C=C(C(=O)O)C=CC2=N1 BB0222182 [0,2,0,0,0,0|2,0,0]=4 74 B16R2.26112 CC1=CC(O)=C2C=C(C(=O)O)C=CC2=N1 BB0221667 [0,2,0,0,0,0|2,0,0]=4 75 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 BB0270267 [0,0,1,1,0,0|2,0,0]=4 76 B16R3.335 NC1=NC2=C(C=CC3=CC=CC=C32)S1 BB0216544 [0,0,0,1,0,1|2,0,0]=4 77 B16R3.335 NC1=NC2=C(S1)C3=CC=CC=C3C=C2 BB0246589 [0,0,0,1,0,1|1,1,0]=4 78 B12R2.32 O=CC1=CC2=C(C=CC=C2)N1 BB0219951 [1,0,0,0,1,0|1,0,0]=3 79 B12R2.32 O=CC1=NC2=C(C=CC=C2)S1 BB0250594 [1,0,0,0,1,0|2,0,0]=4 80 B14R1.68 C=CCOC1=CC=C(NC(C)=O)C=C1 BB0287087 [0,0,1,0,0,1|1,0,1]=4 81 B14R1.778 C=CCOC1=CC=CC(NC(C)=O)=C1 BB0293096 [0,0,1,0,0,1|1,0,1]=4