0 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=C1 ALBB-024742 [0,0,0,0,0,0|2,0,1]=3 1 B14R2.8239 O=C1C=CC2=CC(O)=C(O)C=C2O1 ALBB-023362 [0,0,0,0,0,0|3,0,1]=4 2 B13R2.155 O=C1C=CC2=CC=C(O)C=C2N1 ALBB-023570 [1,0,0,0,0,0|3,0,0]=4 3 B13R2.369 CC1=NC2=CC=CC=C2NC1=O ALBB-020076 [1,0,0,0,0,0|2,0,0]=3 4 B13R2.369 CC1NC2=CC=CC=C2NC1=O ALBB-031489 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.369 CC1OC2=CC=CC=C2NC1=O ALBB-024345 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.369 NC1=CC2=CC=CC=C2C=C1O ALBB-014252 [1,0,0,0,0,0|2,0,0]=3 7 B13R2.369 O=C1NC2=CC=CC=C2OC1=O ALBB-016477 [1,0,0,0,0,0|1,0,1]=3 8 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 ALBB-023916 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 ALBB-026182 [1,0,0,0,0,0|1,0,2]=4 10 B13R2.3683 NC1=CC=C2C=C(N)C=CC2=C1 ALBB-025533 [1,0,0,0,0,0|3,0,0]=4 11 B13R2.3683 NC1=CC=C2OC(=O)C=CC2=C1 ALBB-023917 [1,0,0,0,0,0|2,0,0]=3 12 B13R2.3683 O=C1CCC2=CC(F)=CC=C2N1 ALBB-024711 [1,0,0,0,0,0|0,0,2]=3 13 B15R2.1007 CC1=C(Br)C(=O)NC2=CC=C(Br)C=C21 ALBB-033729 [0,1,0,0,0,0|1,1,0]=3 14 B15R2.1754 CC1=CC2=NC(O)=C(C=O)C=C2C=C1 ALBB-007355 [0,1,0,0,0,0|3,0,0]=4 15 B15R2.21336 COC1=CC=C2NC(=O)C(=O)NC2=C1 ALBB-024630 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.133 CC(Br)C(=O)NC1=CC=C(F)C=C1 ALBB-007251 [0,0,1,0,0,0|1,0,2]=4 17 B13R1.133 CC(Cl)C(=O)NC1=CC=C(F)C=C1 ALBB-018816 [0,0,1,0,0,0|1,0,2]=4 18 B13R1.133 CC(NC1=CC=C(F)C=C1)C(=O)O ALBB-033290 [0,0,1,0,0,0|2,0,1]=4 19 B13R1.133 CC1=CC=C(NC(=O)C(=O)O)C=C1 ALBB-009514 [0,0,1,0,0,0|2,0,0]=3 20 B13R1.133 O=C(O)C(=O)NC1=CC=C(F)C=C1 ALBB-009509 [0,0,1,0,0,0|1,0,0]=2 21 B13R1.148 O=C(O)C(=O)NC1=CC(F)=CC=C1 ALBB-009505 [0,0,1,0,0,0|2,0,1]=4 22 B13R1.2679 CC1=C(NC(=O)CCl)C=CC(F)=C1 ALBB-002391 [0,0,1,0,0,0|1,0,2]=4 23 B13R1.2679 CC1=CC(F)=CC=C1NC(=O)CBr ALBB-030974 [0,0,1,0,0,0|1,0,2]=4 24 B13R1.2679 O=C(CBr)NC1=CC=C(F)C=C1Cl ALBB-030971 [0,0,1,0,0,0|2,0,1]=4 25 B13R1.2679 O=C(CBr)NC1=CC=C(F)C=C1F ALBB-030931 [0,0,1,0,0,0|2,0,1]=4 26 B13R1.2679 O=C(CCl)NC1=CC=C(F)C=C1F ALBB-002316 [0,0,1,0,0,0|2,0,1]=4 27 B13R2.3028 CC1=C(C)C2=CC(Br)=CC=C2N1 ALBB-030056 [0,0,0,0,1,0|2,1,0]=4 28 B13R2.3028 CC1=C(C)C2=CC(F)=CC=C2N1 ALBB-030055 [0,0,0,0,1,0|2,0,0]=3 29 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 ALBB-014097 [0,0,0,0,1,0|1,0,1]=3 30 B13R2.3028 NC1C(=O)NC2=CC=C(F)C=C21 ALBB-022603 [0,0,0,0,1,0|1,0,1]=3 31 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O ALBB-002980 [0,0,0,0,1,0|0,0,1]=2 32 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 ALBB-014228 [0,0,0,0,1,0|2,0,1]=4 33 B13R2.5190 O=C1NC2=C(C=CC(Br)=C2)C1=O ALBB-002981 [0,0,0,0,1,0|1,1,1]=4 34 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 ALBB-011723 [1,0,1,0,0,0|2,0,0]=4 35 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O ALBB-025649 [1,0,1,0,0,0|2,0,0]=4 36 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 ALBB-009501 [1,0,1,0,0,0|1,0,0]=3 37 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 ALBB-002247 [1,0,1,0,0,0|1,0,1]=4 38 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 ALBB-017011 [1,0,1,0,0,0|0,1,1]=4 39 B12R1.226 CC1=CC(\C=C\C(=O)O)=CC=C1 ALBB-021134 [1,0,1,0,0,0|2,0,0]=4 40 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 ALBB-005232 [1,0,1,0,0,0|2,0,0]=4 41 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 ALBB-006261 [1,0,1,0,0,0|2,0,0]=4 42 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 ALBB-007482 [1,0,1,0,0,0|1,1,0]=4 43 B12R1.226 O=[N+]([O-])\C=C\C1=CC=CC(F)=C1 ALBB-031223 [1,0,1,0,0,0|2,0,0]=4 44 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 ALBB-025860 [2,0,0,0,0,0|1,0,1]=4 45 B12R2.24 FC1=CC2=CC=CC=C2C=C1 ALBB-035360 [2,0,0,0,0,0|1,0,0]=3 46 B12R2.24 NC1=CC2=CC=CC=C2N=C1 ALBB-008921 [2,0,0,0,0,0|1,0,1]=4 47 B12R2.24 NC1=CC=C2N=CC=CC2=C1 ALBB-014510 [2,0,0,0,0,0|1,0,1]=4 48 B12R2.24 O=C1C=NC2=CC=CC=C2N1 ALBB-024162 [2,0,0,0,0,0|1,0,0]=3 49 B12R2.24 O=C1CNC2=CC=CC=C2N1 ALBB-006577 [2,0,0,0,0,0|1,0,1]=4 50 B12R2.24 O=C1COC2=CC=CC=C2N1 ALBB-020505 [2,0,0,0,0,0|1,0,1]=4 51 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 ALBB-021965 [2,0,0,0,0,0|0,0,1]=3 52 B12R2.24 OC1=CC2=C(C=CC=N2)C=C1 ALBB-021973 [2,0,0,0,0,0|2,0,0]=4 53 B14R1.6049 CC1=CC(C)=C(NC(=O)C(=O)O)C=C1 ALBB-009525 [0,1,1,0,0,0|2,0,0]=4 54 B14R1.6049 O=C(O)C(=O)NC1=C(F)C=C(F)C=C1 ALBB-009521 [0,1,1,0,0,0|1,0,0]=3 55 B14R2.134 COC1=CC2=C(C=C1)N=CC(O)=C2 ALBB-027822 [1,1,0,0,0,0|1,0,1]=4 56 B14R2.134 COC1=CC=C2C=CC(O)=CC2=C1 ALBB-025932 [1,1,0,0,0,0|2,0,0]=4 57 B14R2.8188 CN1C(=O)C(=O)NC2=CC=CC=C21 ALBB-025407 [1,1,0,0,0,0|1,0,1]=4 58 B14R2.8188 CN1C(=O)NC2=CC=CC=C2C1=O ALBB-019528 [1,1,0,0,0,0|2,0,0]=4 59 B14R2.8235 CC1=CC(=O)C2=CC(O)=CC=C2N1 ALBB-036463 [1,1,0,0,0,0|2,0,0]=4 60 B14R2.8235 CC1=CC(=O)NC2=CC=C(Br)C=C12 ALBB-025305 [1,1,0,0,0,0|0,1,0]=3 61 B14R2.8235 CC1=CC(=O)NC2=CC=C(F)C=C12 ALBB-024320 [1,1,0,0,0,0|0,0,0]=2 62 B14R2.8235 CC1=CC(Cl)=NC2=CC=C(F)C=C12 ALBB-026211 [1,1,0,0,0,0|1,0,1]=4 63 B14R2.8235 CC1=CC=C2NC(=O)C=C(C)C2=C1 ALBB-024297 [1,1,0,0,0,0|1,0,0]=3 64 B14R2.8235 CC1=CC=C2OC(=O)C=C(O)C2=C1 ALBB-007066 [1,1,0,0,0,0|2,0,0]=4 65 B14R2.8235 NC1=C2NC(=O)CCC2=CC(F)=C1 ALBB-026301 [1,1,0,0,0,0|0,0,2]=4 66 B14R2.29369 CN1C(=O)C=CC2=C1C=CC(O)=C2 ALBB-032196 [1,1,0,0,0,0|1,0,0]=3 67 B14R2.1060 CC1=C(C=O)NC2=CC=C(Cl)C=C21 ALBB-013295 [0,1,0,0,1,0|1,1,0]=4 68 B14R2.3274 CCC1=CC2=C(C=C1)NC(=O)C2=O ALBB-002984 [0,1,0,0,1,0|1,0,1]=4 69 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2=O ALBB-002983 [0,1,0,0,1,0|1,0,1]=4 70 B14R2.8716 CN1C(=O)C(=O)C2=CC(Br)=CC=C21 ALBB-023282 [0,1,0,0,1,0|0,1,1]=4 71 B14R2.8716 CN1C(=O)C(=O)C2=CC(F)=CC=C21 ALBB-012258 [0,1,0,0,1,0|0,0,1]=3 72 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(Br)=C1 ALBB-010538 [0,1,0,0,1,0|0,1,1]=4 73 B14R2.9184 CC1=CC2=C(NC(=O)C2=O)C(C)=C1 ALBB-002978 [0,1,0,0,1,0|1,0,1]=4 74 B14R2.9184 O=C1NC2=C(C=C(Br)C=C2Br)C1=O ALBB-014968 [0,1,0,0,1,0|0,1,1]=4 75 B14R2.19008 O=C1NC2=CC=C(Cl)C=C2\C1=N\O ALBB-014431 [0,1,0,0,1,0|0,1,0]=3 76 B16R2.23521 O=C(O)C1=CC2=C(C=CC(Br)=C2)OC1=O ALBB-000940 [0,2,0,0,0,0|1,1,0]=4 77 B16R2.23521 O=C(O)C1=CC2=C(C=CC(Cl)=C2)OC1=O ALBB-000265 [0,2,0,0,0,0|1,1,0]=4 78 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2N1 ALBB-005032 [0,0,1,1,0,0|2,0,0]=4 79 B12R2.606 CC1=CC2=C(C=CC(Cl)=C2)N1 ALBB-006866 [1,0,0,0,1,0|1,1,0]=4 80 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 ALBB-007737 [1,0,0,0,1,0|2,0,0]=4 81 B12R2.606 OC1=NC2=CC=C(F)C=C2N1 ALBB-030906 [1,0,0,0,1,0|1,0,1]=4 82 B14R1.698 CC(=O)CC(=O)NC1=CC=C(F)C=C1 ALBB-024317 [0,0,1,0,0,1|0,0,2]=4