0 B12R1.252 CC(=O)CCCc1ccccn1 ZERO/009547 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.252 c1ccnc(c1)CCCC(=O)O ZERO/008945 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.252 c1cnccc1CCCC(=O)O ZERO/008953 [0,0,0,0,0,0|1,0,0]=1 3 B11R1.28 c1ccc(cc1)CCN=C=S ZERO/008133 [1,0,0,0,0,0|1,1,1]=4 4 B11R1.28 c1ccnc(c1)CCCC#N ZERO/009392 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.28 c1ccnc(c1)CCCCN ZERO/009720 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.45 c1cc(cnc1)C(=O)CCC(=O)O ZERO/004996 [0,1,0,0,0,0|1,0,1]=3 7 B13R1.351 c1ccnc(c1)CCC(C(=O)O)N ZERO/009065 [0,1,0,0,0,0|1,0,0]=2 8 B13R1.718 c1ccc(cc1)CCNC(=O)CCl ZERO/001157 [0,1,0,0,0,0|2,0,0]=3 9 B13R2.10 c1ccc(cc1)C2=CC(=O)CC2 ZERO/010688 [0,0,0,1,0,0|1,0,1]=3 10 B13R2.10 c1ccc(cc1)N2CCC(=O)N2 ZERO/001451 [0,0,0,1,0,0|2,0,0]=3 11 B13R2.72 c1ccc2c(c1)c(n[nH]2)C(=O)O ZERO/005535 [0,0,0,1,0,0|2,0,1]=4 12 B11R1.91 c1ccc(cc1)SCC(=O)O ZERO/001476 [0,0,0,0,1,0|1,0,0]=2 13 B11R1.91 c1ccnc(c1)CCC(=O)O ZERO/009473 [0,0,0,0,1,0|1,0,0]=2 14 B11R1.91 c1ccnc(c1)CCC(=S)N ZERO/010002 [0,0,0,0,1,0|2,1,0]=4 15 B11R1.91 c1cnccc1CCC(=O)O ZERO/004673 [0,0,0,0,1,0|1,0,0]=2 16 B11R1.172 c1ncn(n1)CCCC(=O)O ZERO/009601 [0,0,0,0,1,0|3,0,0]=4 17 B10R1.17 c1cc(cnc1)CCCBr ZERO/009226 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.17 c1ccnc(c1)CCCN ZERO/004569 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.21 c1cc(ccc1CCC(=O)O)Cl ZERO/008485 [0,1,0,0,1,0|0,0,0]=2 20 B12R1.21 c1cc(ccc1CCC(=O)O)N ZERO/005990 [0,1,0,0,1,0|0,0,0]=2 21 B12R1.21 c1cc(ccc1N)OCC(=O)O ZERO/001282 [0,1,0,0,1,0|1,0,0]=3 22 B12R1.43 CC(=O)C(Cc1ccccc1)N ZERO/008833 [0,1,0,0,1,0|1,0,0]=3 23 B12R1.107 c1ccc(cc1)C(CC(=O)O)N ZERO/001726 [0,1,0,0,1,0|0,0,0]=2 24 B12R1.107 c1ccc(cc1)C(C[N+](=O)[O-])O ZERO/001773 [0,1,0,0,1,0|1,0,1]=4 25 B12R1.226 c1cc(cc(c1)F)CCC(=O)O ZERO/004851 [0,1,0,0,1,0|0,0,0]=2 26 B12R1.891 c1ccc(cc1)CCS(=O)(=O)Cl ZERO/009900 [0,1,0,0,1,0|1,0,1]=4 27 B12R1.54 c1cc(oc1)C(=O)CCC(=O)O ZERO/009931 [0,1,0,0,1,0|1,0,1]=4 28 B14R1.818 CC(=O)CC(=O)NCc1ccccc1 ZERO/001293 [0,1,0,0,0,1|1,0,1]=4 29 B14R1.415 c1ccc(cc1)C(=O)CC(=O)C(=O)O ZERO/009197 [0,2,0,0,0,0|0,0,2]=4 30 B14R1.76 COc1cccc(c1)\C=C\CC(=O)O ZERO/010944 [0,2,0,0,0,0|0,0,2]=4 31 B14R1.161 Cc1ccccc1OCC(C(=O)O)O ZERO/006283 [0,2,0,0,0,0|1,0,0]=3 32 B12R2.2 c1ccc(cc1)C2CCNC2 ZERO/010603 [1,0,0,1,0,0|2,0,0]=4 33 B14R2.2 c1ccc2c(c1)c(n[nH]2)CC(=O)O ZERO/009754 [0,0,0,1,0,1|1,0,1]=4 34 B14R2.31359 c1ccc2c(c1)CCNC2C(=O)O ZERO/001333 [0,0,0,1,0,1|0,0,0]=2 35 B14R2.768 c1ccc2c(c1)nc(s2)CC(=O)O ZERO/009774 [0,1,0,1,0,0|1,0,1]=4 36 B14R2.768 c1ccc2c(c1)nn(n2)CC(=O)O ZERO/002816 [0,1,0,1,0,0|2,0,0]=4 37 B14R2.781 c1ccc2c(c1)CC(NC2)C(=O)O ZERO/005048 [0,1,0,1,0,0|1,0,0]=3 38 B14R2.260 CC1CN(NC1=O)c2ccccc2 ZERO/001086 [0,1,0,1,0,0|2,0,0]=4 39 B10R1.66 c1cnoc1CCC(=O)O ZERO/005937 [0,0,0,0,2,0|2,0,0]=4