0 B13R2.369 CC1=Cc2ccccc2NC1=O J5I [0,0,0,0,0,0|2,0,0]=2 1 B13R2.369 CN1Cc2ccccc2NC1=O 3PF [0,0,0,0,0,0|3,0,1]=4 2 B13R2.369 C[C@@H]1C(=O)Nc2c(cccn2)N1 1JX [0,0,0,0,0,0|2,0,2]=4 3 B13R2.369 C[C@H]1C(=O)Nc2ccccc2N1 5QY [0,0,0,0,0,0|3,0,1]=4 4 B13R2.369 c1ccc2c(c1)C=C(C(=O)N2)O G3E [0,0,0,0,0,0|1,0,0]=1 5 B13R2.369 c1ccc2c(c1)C=C(C(=O)O2)O SE2 [0,0,0,0,0,0|2,0,0]=2 6 B12R2.24 c1cc2cc(ccc2nc1)N ES5 [1,0,0,0,0,0|2,0,0]=3 7 B12R2.24 c1ccc2c(c1)C=CC(=O)N2 OCH [1,0,0,0,0,0|1,0,0]=2 8 B12R2.24 c1ccc2c(c1)C=CC(=O)O2 COU [1,0,0,0,0,0|2,0,0]=3 9 B12R2.24 c1ccc2c(c1)cc(cn2)N 4FS [1,0,0,0,0,0|2,0,1]=4 10 B12R2.24 c1ccc2c(c1)ccc(n2)N 2AQ [1,0,0,0,0,0|2,0,1]=4 11 B12R2.24 c1ccc2cc(ccc2c1)O 03V [1,0,0,0,0,0|2,0,0]=3 12 B14R2.8188 CC1=C(C(=O)c2ccccc2N1)O HQD [0,1,0,0,0,0|2,0,0]=3 13 B14R2.8188 c1ccc2c(c1)CC(=O)N(C2=O)O 0N7 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O 4LV [0,0,1,0,0,0|3,0,0]=4 15 B12R1.43 c1ccc(cc1)/C=C(/C(=O)O)\N 23F [0,0,1,0,0,0|3,0,0]=4 16 B12R1.43 c1ccc(cc1)CC(=O)C(=O)O 1PY [0,0,1,0,0,0|3,0,0]=4 17 B12R1.43 c1ccc(cc1)CC(=O)C(=O)O PPY [0,0,1,0,0,0|3,0,0]=4 18 B12R1.43 c1ccc(cc1)\C=C(\C(=O)O)/F 4LW [0,0,1,0,0,0|3,0,0]=4 19 B12R2.18 c1ccc2c(c1)C(=O)C(=O)N2 ISN [0,0,0,0,1,0|1,0,1]=3 20 B12R2.100 c1c[nH]c2c1cc(c(c2)O)O 3ID [0,0,0,0,1,0|1,0,2]=4 21 B11R1.91 c1ccc(cc1)/C=C/C(=O)O TCA [1,0,1,0,0,0|2,0,0]=4 22 B11R1.91 c1ccc(cc1)\C=C\C(=O)N DH6 [1,0,1,0,0,0|1,0,0]=3 23 B11R2.20 c1ccc2c(c1)cncn2 QUZ [2,0,0,0,0,0|2,0,0]=4 24 B11R2.20 c1ccc2ccccc2c1 NPY [2,0,0,0,0,0|2,0,0]=4 25 B13R1.133 c1cc(ccc1\C=C(/C(=O)O)\O)O EN1 [0,1,1,0,0,0|2,0,0]=4 26 B13R1.470 c1ccc(c(c1)NC(=O)C=NO)Br 4Z3 [0,1,1,0,0,0|2,0,0]=4 27 B13R2.32 CN1c2ccccc2C=CC1=O 12Q [1,1,0,0,0,0|1,0,0]=3 28 B13R2.32 c1ccc2c(c1)ccc(c2O)O D1N [1,1,0,0,0,0|2,0,0]=4 29 B13R2.57 c1ccc2cc(ccc2c1)CO 2NA [1,1,0,0,0,0|2,0,0]=4 30 B13R2.155 c1cc2c(cc1O)OC(=O)C=C2 07L [1,1,0,0,0,0|2,0,0]=4 31 B13R2.162 c1cc2c(c(c1)O)OC(=O)C=C2 8CM [1,1,0,0,0,0|2,0,0]=4 32 B13R2.328 CC1=CC(=O)Oc2c1cccc2 ZZ1 [1,1,0,0,0,0|2,0,0]=4 33 B13R2.328 c1ccc2c(c1)C(=CC(=O)O2)O 4HC [1,1,0,0,0,0|2,0,0]=4 34 B13R2.328 c1cnc2c(n1)C(=O)NC(=O)N2 LUZ [1,1,0,0,0,0|2,0,0]=4 35 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)O2 3AV [1,1,0,0,0,0|2,0,0]=4 36 B13R2.3683 Cc1ccc2cc(ccc2n1)N MQN [1,1,0,0,0,0|2,0,0]=4 37 B13R2.3683 c1cc2c(cc1Cl)C=CC(=O)N2 0TU [1,1,0,0,0,0|1,0,0]=3 38 B13R2.3683 c1cc2c(cc1N)C=CC(=O)O2 4JQ [1,1,0,0,0,0|2,0,0]=4 39 B13R2.5179 c1cc2c(ccnc2cc1Cl)O MRW [1,1,0,0,0,0|2,0,0]=4 40 B13R2.5179 c1cc2cc(ccc2c(c1)O)O DIN [1,1,0,0,0,0|2,0,0]=4 41 B13R2.5179 c1cc2cc(cnc2c(c1)N)O A7W [1,1,0,0,0,0|1,0,1]=4 42 B13R2.3028 c1cc2c(cc1Cl)C(=O)C(=O)N2 2HQ [0,1,0,0,1,0|1,0,1]=4 43 B13R2.3028 c1cc2c(cc1F)[C@H](C(=O)N2)O 0TI [0,1,0,0,1,0|1,0,1]=4 44 B15R2.984 c1ccc2c(c1)cc(c(n2)C(=O)O)O HQU [0,2,0,0,0,0|1,0,1]=4 45 B15R2.9032 CN1c2ccccc2C(=C(C1=O)O)O LI6 [0,2,0,0,0,0|1,0,0]=3 46 B13R2.435 c1ccc2c(c1)cc(o2)C(=O)O BZ2 [0,0,1,1,0,0|2,0,0]=4 47 B11R1.36 c1ccc(cc1)C(=O)C(=O)O 173 [0,0,1,0,1,0|2,0,0]=4 48 B11R2.10 Cc1cc2ccccc2[nH]1 2MI [1,0,0,0,1,0|2,0,0]=4 49 B11R2.36 c1cc(cc2c1cc[nH]2)O F60 [1,0,0,0,1,0|1,0,1]=4 50 B11R2.36 c1cc2c(cc[nH]2)cc1O 5H1 [1,0,0,0,1,0|2,0,0]=4