+2 CCCO~   -0.145
+4 ClCCCl~   -0.140
+7 S(C(N)=N)C~   -0.602
+26 Clc1cc2NC(=O)N(c2cc1)C1CCN(CC1)CCCN1c2c(NC1=O)cccc2~   -0.850
+37 s1ccnc1CCN~   -0.420
+51 Cl\C=C/Cl~   -0.130
+52 Clc1ccc(cc1)C(=O)n1c2c(cc(OC)cc2)c(CC(O)=O)c1C~   -1.260
+61 O=C(NCCCOC1=CC=CC(=C1)CN2CCCCC2)C3=CC=CC=C3~   -0.240
+64 OC(=O)c1ccc(cc1)-c1ccccc1~   -1.260
+66 n1ccccc1CCN(C)C~   -0.060
+75 Brc1cc(C)c(nc1)CCCCNC=1NC(=O)C(=CN=1)Cc1ccc(nc1)C~   -1.880
+76 CCO~   -0.160
+77 CC(C)O~   -0.150
+81 ClCCl~   -0.284
+90 ClC(Cl)C~   -0.280
+112 Ic1ccc(cc1CN1CCCCC1)CN1CCCCC1~    0.980
+123 C~    0.035
+139 CCC1=CC=CC=C1~    0.229
+158 s1cc(nc1N=C(N)N)-c1cc(N)ccc1~   -1.150
+171 O=C1N(C)C(CC1)c1cccnc1~   -0.348
+177 CN(C)CC1=CC=C(CSCCNC2=NC=C(CC3=CN=C(C)C=C3)C(=O)N2)O1~   -1.060
+179 ClC(Cl)CCl~   -0.100
+184 ClC=C(F)F~   -0.020
+185 OC(C(O)C(O)CO)C(O)CO~   -1.600
+191 O(C)c1cc(ccc1OC)C(C(C)C)(CCCN(CCc1cc(OC)c(OC)cc1)C)C#N~   -0.640
+193 O(CCCO)c1cc(ccc1)CN1CCCCC1~   -0.020
+194 [nH]1nc(nc1N)-c1cc(ncc1)N(C)C~   -1.170
+201 CN1CN(C2=CC=CC=C2)C3(CCN(CCCC(=O)C4=CSC(=C4)I)CC3)C1=O~   -0.250
+228 IC1=CC(C(CCCN4CCC2(CC4)C(N(CN2C3=CC=CC=C3)C)=O)=O)=CS1~   -0.254
