File size: 15,566 Bytes
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CN(C)C(=O)c1ccc(cc1)OC -11.0100
CS(=O)(=O)Cl -4.8700
CC(C)C=C 1.8300
CCc1cnccn1 -5.4500
CCCCCCCO -4.2100
Cc1cc(cc(c1)O)C -6.2700
CC(C)C(C)C 2.3400
CCCC(C)(C)O -3.9200
C[C@@H]1CCCC[C@@H]1C 1.5800
CC[C@H](C)O -4.6200
C(Br)Br -1.9600
CC[C@H](C(C)C)O -3.8800
CCc1ccccn1 -4.3300
CCCCC(=O)OCC -2.4900
c1ccc(cc1)S -2.5500
CC(=CCC/C(=C\CO)/C)C -4.7800
c1ccc2c(c1)CCC2 -1.4600
CCOc1ccccc1 -2.2200
c1cc(ccc1O)Br -5.8500
CCCC(C)(C)C 2.8800
CC(=O)OCCOC(=O)C -6.3400
CCOP(=S)(OCC)SCSP(=S)(OCC)OCC -6.1000
C1CCCC(CC1)O -5.4800
COC(=O)C1CC1 -4.1000
c1ccc(cc1)C#N -4.1000
CCCCC#N -3.5200
CC(C)(C)O -4.4700
CC(C)C(=O)C(C)C -2.7400
CCC=O -3.4300
CN(C)C=O -7.8100
Cc1ccc(cc1)C -0.8000
C=CCC=C 0.9300
Cc1cccc(c1C)Nc2ccccc2C(=O)O -6.7800
CN(C)C(=O)c1ccccc1 -9.2900
CCNCC -4.0700
CC(C)(C)c1ccc(cc1)O -5.9100
CC(C)CCOC=O -2.1300
CCCCCCCCCCO -3.6400
CCC(=O)OCC -2.6800
CCCCCCCCC 3.1300
CC(=O)NC -10.0000
CCCCCCCC=C 2.0600
c1ccc2cc(ccc2c1)O -8.1100
c1cc(c(cc1Cl)Cl)Cl -1.1200
C([C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)O -23.6200
CCCC(=O)OC -2.8300
c1ccc(c(c1)C=O)O -4.6800
C1CNC1 -5.5600
CCCNCCC -3.6500
c1ccc(cc1)N -5.4900
C(F)(F)(F)F 3.1200
CC[C@@H](C)CO -4.4200
c1ccc(c(c1)O)I -6.2000
COc1cccc(c1O)OC -6.9600
CCC#C -0.1600
c1ccc(cc1)C(F)(F)F -0.2500
NN -9.3000
Cc1ccccn1 -4.6300
CCNc1nc(nc(n1)Cl)NCC -10.2200
c1ccc2c(c1)Oc3cc(c(cc3O2)Cl)Cl -3.5600
CCCCCCCCN -3.6500
N -4.2900
c1ccc(c(c1)C(F)(F)F)C(F)(F)F 1.0700
COC(=O)c1ccc(cc1)O -9.5100
CCCCCc1ccccc1 -0.2300
CC(F)F -0.1100
c1ccc(cc1)n2c(=O)c(c(cn2)N)Cl -16.4300
C=CC=C 0.5600
CN(C)C -3.2000
CCCCCC(=O)N -9.3100
CC(C)CO[N+](=O)[O-] -1.8800
c1ccc2c(c1)C(=O)c3cccc(c3C2=O)NCCO -14.2100
C(CO[N+](=O)[O-])O -8.1800
CCCCCCC(=O)C -2.8800
CN1CCNCC1 -7.7700
CCN -4.5000
C1C=CC=CC=C1 -0.9900
c1ccc2c(c1)Cc3ccccc3C2 -3.7800
CC(Cl)Cl -0.8400
COc1cccc(c1)O -7.6600
c1cc2cccc3c2c(c1)CC3 -3.1500
CCCCCCCCBr 0.5200
c1ccc(cc1)CO -6.6200
c1c(c(=O)[nH]c(=O)[nH]1)Br -18.1700
CCCC 2.1000
CCl -0.5500
CC(C)CBr -0.0300
CC(C)SC(C)C -1.2100
CCCCCCC 2.6700
c1cnc[nH]1 -9.6300
c1cc2c(cc1Cl)Oc3cc(c(c(c3O2)Cl)Cl)Cl -3.8400
CC[C@H](C)n1c(=O)c(c([nH]c1=O)C)Br -9.7300
C(I)I -2.4900
CCCN(CCC)C(=O)SCCC -4.1300
C[N+](=O)[O-] -4.0200
CCOC -2.1000
COC(CCl)(OC)OC -4.5900
CC(C)C 2.3000
CC(C)CC(=O)O -6.0900
CCOP(=O)(OCC)O/C(=C/Cl)/c1ccc(cc1Cl)Cl -7.0700
CCCCl -0.3300
CCCSCCC -1.2800
CCC[C@H](CC)O -4.0600
CC#N -3.8800
CN(CC(F)(F)F)c1ccccc1 -1.9200
[C@@H](C(F)(F)F)(OC(F)F)Cl 0.1000
C=CCCC=C 1.0100
Cc1cccc(c1)C -0.8300
CC(=O)OC -3.1300
COC(c1ccccc1)(OC)OC -4.0400
CCOC(=O)c1ccccc1 -3.6400
CCCS -1.1000
CCCCCC(=O)C -3.0400
CC1(Cc2cccc(c2O1)OC(=O)NC)C -9.6100
c1ccc(cc1)CBr -2.3800
CCCCCC(=O)OCC -2.2300
CCCOC -1.6600
CN1CCOCC1 -6.3200
c1cc(cc(c1)O)C#N -9.6500
c1cc(c(cc1c2c(c(cc(c2Cl)Cl)Cl)Cl)Cl)Cl -4.3800
CCCc1ccccc1 -0.5300
Cn1cnc2c1c(=O)n(c(=O)n2C)C -12.6400
CNC -4.2900
C(=C(F)F)(C(F)(F)F)F 2.9300
c1cc(ccc1O)Cl -7.0300
C1CCNCC1 -5.1100
c1ccc2c(c1)ccc3c2cccc3 -3.8800
CI -0.8900
COc1c(cc(c(c1O)OC)Cl)Cl -6.4400
C(=C/Cl)\Cl -0.7800
CCCCC 2.3000
CCCC#N -3.6400
[C@@H](C(F)(F)F)(F)Br 0.5000
CC(C)Cc1cnccn1 -5.0400
CC[C@H](C)O[N+](=O)[O-] -1.8200
c1ccc(cc1)c2cc(ccc2Cl)Cl -2.4600
c1ccc(cc1)c2cc(c(c(c2Cl)Cl)Cl)Cl -3.4800
CC[C@@H](C)C(C)C 2.5200
C[C@H](CC(C)C)O -3.7300
C1CCOCC1 -3.1200
C1CC1 0.7500
c1c(cc(c(c1Cl)Cl)Cl)c2cc(c(c(c2Cl)Cl)Cl)Cl -3.1700
C=C(Cl)Cl 0.2500
CC(C)CO -4.5000
CCCOC(=O)CC -2.4400
C(C(Cl)(Cl)Cl)(Cl)(Cl)Cl -0.6400
CSc1ccccc1 -2.7300
CCc1ccccc1O -5.6600
CC(C)(C)Cl 1.0900
CC(=C)C=C 0.6800
Cc1ccc(cc1)C(C)C -0.6800
Cn1ccnc1 -8.4100
C(CO)O -9.3000
c1ccc(c(c1)Cl)Cl -1.3600
c1c(=O)[nH]c(=O)[nH]c1Cl -15.8300
CCCOC=O -2.4800
c1ccc2c(c1)Oc3ccc(cc3O2)Cl -3.1000
CCCCCC(=O)O -6.2100
CCOC(=O)CCC(=O)OCC -5.7100
Cc1ccnc(c1)C -4.8600
C1CCC=CC1 0.1400
CN1CCN(CC1)C -7.5800
c1cc(c(cc1c2cc(c(c(c2Cl)Cl)Cl)Cl)Cl)Cl -3.0400
C1=CC(=O)C=CC1=O -6.5000
COC(=O)CCl -4.0000
CCCC=O -3.1800
CCc1ccccc1 -0.7900
C(=C(Cl)Cl)Cl -0.4400
CCN(CC)CC -3.2200
c1cc2c(cc1Cl)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2 -4.1500
Cc1ccncc1C -5.2200
c1(=O)[nH]c(=O)[nH]c(=O)[nH]1 -18.0600
c1ccc(cc1)C=O -4.0200
c1ccnc(c1)Cl -4.3900
C=CCCl -0.5700
Cc1ccc(cc1)C(=O)C -4.7000
C=O -2.7500
Cc1ccccc1Cl -1.1400
CC(=O)N1CCCC1 -9.8000
CC(OC)(OC)OC -4.4200
CCCCc1ccccc1 -0.4000
CN(C)c1ccccc1 -3.4500
CC(C)OC -2.0100
c12c(c(c(c(c1Cl)Cl)Cl)Cl)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2 -4.5300
c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)c2c(c(c(c(c2Cl)Cl)Cl)Cl)Cl -2.9800
C(C(Cl)Cl)Cl -1.9900
CNc1ccccc1 -4.6900
CC(C)OC(=O)C -2.6400
c1ccccc1 -0.9000
c1cc(c(c(c1)Cl)Cl)Cl -1.2400
CCOP(=S)(OCC)SCSc1ccc(cc1)Cl -6.5000
COP(=S)(OC)SCn1c(=O)c2ccccc2nn1 -10.0300
c1ccc2c(c1)Oc3c(cc(c(c3O2)Cl)Cl)Cl -4.0500
CC(=C)C(=C)C 0.4000
CCCCC=C 1.5800
S -0.7000
CCOCC -1.5900
CCNc1nc(nc(n1)SC)NC(C)C -7.6500
CCCCOC(=O)c1ccc(cc1)O -8.7200
CCCCCCOC(=O)C -2.2600
C1CCC(=O)C1 -4.7000
CCCCC(=O)O -6.1600
CCBr -0.7400
Cc1ccc2cc(ccc2c1)C -2.6300
CCCCCCO -4.4000
c1ccc(cc1)c2ccccc2Cl -2.6900
CC1=CCCCC1 0.6700
CCCCCCO[N+](=O)[O-] -1.6600
C(Br)(Br)Br -2.1300
CCc1ccc(cc1)O -6.1300
CCCOCCO -6.4000
c1ccc(cc1)OC=O -3.8200
c1c(c(=O)[nH]c(=O)[nH]1)I -18.7200
CCCC(=O)O -6.3500
COC(C(F)(F)F)(OC)OC -0.8000
C1[C@H]([C@@H]([C@H]([C@H](O1)O)O)O)O -20.5200
C(F)(F)(F)Br 1.7900
CCCCO -4.7200
c1ccc(cc1)F -0.8000
CCOC(=O)C -2.9400
CC(C)COC(=O)C(C)C -1.6900
CC(C)(C)OC -2.2100
C1=C[C@@H]([C@@H]2[C@H]1[C@@]3(C(=C([C@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl -2.5500
CCC(=O)CC -3.4100
COC(=O)C(F)(F)F -1.1000
c1ccc2ccccc2c1 -2.4000
c1cc(c(c(c1c2cc(c(c(c2Cl)Cl)Cl)Cl)Cl)Cl)Cl -4.4000
CC(=O)Oc1ccccc1C(=O)O -9.9400
CC(=O)C(C)(C)C -3.1100
COS(=O)(=O)C -4.8700
CCc1ccncc1 -4.7300
CC(C)NC(C)C -3.2200
c1cc2c(cc1Cl)Oc3ccc(cc3O2)Cl -3.6700
CCCCCCCN -3.7900
CC1CCCC1 1.5900
CCC 2.0000
C[C@H]1CCCO1 -3.3000
CNC(=O)Oc1cccc2c1cccc2 -9.4500
c1cc(cc(c1)O)C=O -9.5200
c1ccc2cc3ccccc3cc2c1 -3.9500
C(Cl)Cl -1.3100
CC(C)(C)C(=O)OC -2.4000
C([N+](=O)[O-])(Cl)(Cl)Cl -1.4500
C1CC[S+2](C1)([O-])[O-] -8.6100
Cc1cccc(c1O)C -5.2600
Cc1cccc(c1)O -5.4900
c1ccc2c(c1)C(=O)c3c(ccc(c3C2=O)O)N -9.5300
c1ccc2c(c1)C(=O)c3c(ccc(c3C2=O)N)N -11.8500
CCCCCCCC(=O)C -2.4900
CCCCN -4.2400
CCCC(=O)OCC -2.4900
Cc1ccc(cc1)N -5.5700
CCCCCCI 0.0800
C(C(F)(Cl)Cl)(F)(F)Cl 1.7700
COP(=O)(OC)OC -8.7000
c1cc(cc(c1)Cl)Cl -0.9800
Cc1cc(c2ccccc2c1)C -2.4700
CCCC(C)C 2.5100
CCOP(=S)(OCC)Oc1c(cc(c(n1)Cl)Cl)Cl -5.0400
C(C(F)(F)F)Cl 0.0600
C=C 1.2800
CCCCCI -0.1400
COC(OC)OC -4.4200
CCCCCCCCCC 3.1600
C[C@@H](CO[N+](=O)[O-])O[N+](=O)[O-] -4.9500
CC=C 1.3200
Cc1c[nH]c2c1cccc2 -5.8800
COP(=O)([C@H](C(Cl)(Cl)Cl)O)OC -12.7400
C1CCCCC1 1.2300
CC(=CCC/C(=C/CO)/C)C -4.4500
CC(C)c1ccccc1 -0.3000
CC(C)C(C)C(C)C 2.5600
CC(C)C(=O)C -3.2400
CCCCNCCCC -3.2400
CCCCS -0.9900
c1ccc2c(c1)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2 -3.8100
COc1c(c(c(c(c1Cl)C=O)Cl)OC)O -8.6800
C1CCC(CC1)N -4.5900
C(F)(F)Cl -0.5000
COC(=O)c1ccc(cc1)[N+](=O)[O-] -6.8800
CC(=O)c1cccnc1 -8.2600
CC#C -0.4800
CCCCCCCCC=O -2.0700
CCC(=O)O -6.4600
C(Cl)(Cl)Cl -1.0800
Cc1cccc(c1C)C -1.2100
C 2.0000
c1ccc(cc1)CCl -1.9300
CC1CCCCC1 1.7000
Cc1cccs1 -1.3800
c1ccncc1 -4.6900
CCCCCl -0.1600
C[C@H]1CC[C@@H](O1)C -2.9200
Cc1ccc(c(c1)OC)O -5.8000
C1[C@H]([C@@H]2[C@H]([C@H]1Cl)[C@]3(C(=C([C@@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl -3.4400
Cc1ccccc1 -0.9000
CC(C)COC=O -2.2200
CCOC(=O)c1ccc(cc1)O -9.2000
CCOCCOCC -3.5400
CCCCCOC(=O)CC -2.1100
CCCc1ccc(cc1)O -5.2100
CC=C(C)C 1.3100
C(CCl)Cl -1.7900
CCC(C)(C)CC 2.5600
Cc1cc2ccccc2cc1C -2.7800
Cc1cccc(n1)C -4.5900
COC(C(Cl)Cl)(F)F -1.1200
CCOCCOC(=O)C -5.3100
COc1cccc(c1)N -7.2900
c1cc(cnc1)C=O -7.1000
CCC(C)(C)O -4.4300
CCc1cccc(c1N(COC)C(=O)CCl)CC -8.2100
Cn1cccc1 -2.8900
COCOC -2.9300
CCC(CC)O -4.3500
CCCCCCCCCC(=O)C -2.1500
C(CBr)Cl -1.9500
c1ccc(cc1)I -1.7400
CC1=CC(=O)CC(C1)(C)C -5.1800
CCI -0.7400
CCCc1ccc(c(c1)OC)O -5.2600
CC(C)Br -0.4800
Cc1ccc(cc1)Br -1.3900
c1cc(ccc1C#N)O -10.1700
CS(=O)(=O)C -10.0800
CCc1cccc(c1)O -6.2500
CC1=CC[C@H](C[C@@H]1O)C(=C)C -4.4400
c1cc(ccc1Br)Br -2.3000
COc1c(ccc(c1C(=O)O)Cl)Cl -9.8600
CC/C=C\C 1.3100
CC 1.8300
COc1ccccc1OC -5.3300
CCSCC -1.4600
c1cc(cnc1)C#N -6.7500
c1cc(c(cc1O)Cl)Cl -7.2900
COc1ccccc1 -2.4500
Cc1ccc(c(c1)O)C -5.9100
c1cc(ccc1Cl)Cl -1.0100
C(F)Cl -0.7700
CCCC=C 1.6800
c1cc(c(c(c1Cl)Cl)Cl)Cl -1.3400
CCCCCC#C 0.6000
CCCCCCCCC(=O)C -2.3400
c1ccc(cc1)Cl -1.1200
CN(C)CCOC(c1ccccc1)c2ccccc2 -9.3400
CCCCC=O -3.0300
c1ccc(cc1)Oc2ccccc2 -2.8700
C1CCC(=O)CC1 -4.9100
CCCC[N+](=O)[O-] -3.0900
c1cnccc1C=O -7.0000
C(CCl)OCCCl -4.2300
CC[N+](=O)[O-] -3.7100
c1cc(cnc1)Cl -4.0100
CBr -0.8200
CO -5.1000
CCCCCCC=O -2.6700
c1cc(c(c(c1)Cl)c2c(cccc2Cl)Cl)Cl -2.2800
c1ccc(c(c1)N)[N+](=O)[O-] -7.3700
CN1CCCCC1 -3.8800
CCCCCCCC=O -2.2900
c1ccc(cc1)[N+](=O)[O-] -4.1200
C[C@@H]1CC[C@H](C(=O)C1)C(C)C -2.5300
C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O)O -25.4700
CF -0.2200
CS(=O)C -9.2800
c1ccc2c(c1)Oc3ccccc3O2 -3.1500
Cc1ccccc1N -5.5300
CCCCBr -0.4000
CCCCCCCCCO -3.8800
Cc1ccncc1 -4.9300
C(=C(Cl)Cl)(Cl)Cl 0.1000
CC(C)(C)Br 0.8400
C=C(c1ccccc1)c2ccccc2 -2.7800
CCc1ccc(cc1)C -0.9500
Cc1cccnc1 -4.7700
COCC(OC)(OC)OC -5.7300
c1ccc-2c(c1)Cc3c2cccc3 -3.3500
CC(=O)N -9.7100
COS(=O)(=O)OC -5.1000
C(C(Cl)Cl)(Cl)Cl -2.3700
COC(=O)C1CCCCC1 -3.3000
CCCCCCBr 0.1800
CCCCCCCBr 0.3400
c1ccc2c(c1)Oc3cccc(c3O2)Cl -3.5200
COC(CC#N)(OC)OC -6.4000
CC[C@H](C)Cl 0.0000
CCCCCCc1ccccc1 -0.0400
COc1cc(c(c(c1O)OC)Cl)C=O -7.7800
c1cc(cc(c1)C(F)(F)F)C(F)(F)F 1.0700
c1ccc(cc1)Cn2ccnc2 -7.6300
c1ccc2c(c1)cccc2N -7.2800
CCOC(=O)CC(=O)OCC -6.0000
CC(=O)C1CC1 -4.6100
c1cc[nH]c1 -4.7800
c1cc(c(cc1c2ccc(cc2F)F)C(=O)O)O -9.4000
CC1CCC(CC1)C 2.1100
C1CCC(CC1)O -5.4600
CN(C)CCC=C1c2ccccc2CCc3c1cccc3 -7.4300
c1cc(ccc1O)F -6.1900
c1ccc(c(c1)N)Cl -4.9100
Cc1ccc(c(c1)C)C -0.8600
CCc1ccccc1C -0.8500
C[C@@H]1CC[C@H](CC1=O)C(=C)C -3.7500
c1ccc(cc1)c2ccccc2 -2.7000
Cc1cccc(c1C)O -6.1600
COP(=S)(OC)Oc1ccc(cc1)[N+](=O)[O-] -7.1900
CCOP(=S)(OCC)Oc1ccc(cc1)[N+](=O)[O-] -6.7400
CCN(CC)c1c(cc(c(c1[N+](=O)[O-])N)C(F)(F)F)[N+](=O)[O-] -5.6600
CSC -1.6100
C[C@@H](c1cccc(c1)C(=O)c2ccccc2)C(=O)O -10.7800
C1CCC(C1)O -5.4900
CCCCC(=O)OC -2.5600
CCCC(=C)C 1.4700
C[C@@H](c1ccc(c(c1)F)c2ccccc2)C(=O)O -8.4200
CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])S(=O)(=O)C)[N+](=O)[O-] -7.9800
C=CCl -0.5900
Cc1ccc(cc1)C(=O)N(C)C -9.7600
CCCC(=O)CCC -2.9200
COC(=O)c1ccccc1 -3.9200
Cc1ccc(cc1)C=O -4.2700
CCCC(=O)OCCC -2.2800
C1CNCCN1 -7.4000
CCOP(=S)(OCC)S[C@@H](CCl)N1C(=O)c2ccccc2C1=O -5.7400
CCOCCO -6.6900
CCC(C)CC 2.5100
Cc1cnccn1 -5.5100
CCC[N+](=O)[O-] -3.3400
Cc1cc(cc(c1)C)C -0.9000
c1c(c(=O)[nH]c(=O)[nH]1)F -16.9200
CCO -5.0000
Cc1ccc(c2c1cccc2)C -2.8200
c1c2c(cc(c1Cl)Cl)Oc3cc(c(cc3O2)Cl)Cl -3.3700
c1cc(c(c(c1)Cl)C#N)Cl -4.7100
CCOC=O -2.5600
c1c(c(cc(c1Cl)Cl)Cl)Cl -1.3400
CCOC(OCC)Oc1ccccc1 -5.2300
c1cc(cc(c1)O)[N+](=O)[O-] -9.6200
CCCCCCCCO -4.0900
CCC=C 1.3800
C(Cl)(Cl)(Cl)Cl 0.0800
c1ccc(cc1)CCO -6.7900
CN(C)C(=O)Nc1ccccc1 -9.1300
CSSC -1.8300
C1C=CC[C@@H]2[C@@H]1C(=O)N(C2=O)SC(Cl)(Cl)Cl -9.0100
CC(=O)OCC(COC(=O)C)OC(=O)C -8.8400
COC -1.9100
CCCCCC 2.4800
C(CBr)Br -2.3300
C(C(Cl)(Cl)Cl)(Cl)Cl -1.2300
c1c(c(=O)[nH]c(=O)[nH]1)C(F)(F)F -15.4600
Cc1cccc(c1N)C -5.2100
CCCOC(=O)C -2.7900
c1ccc2c(c1)cccn2 -5.7200
CCS -1.1400
CCSSCC -1.6400
c1ccsc1 -1.4000
CCc1cccc2c1cccc2 -2.4000
CCCC(=O)C -3.5200
c1c(c(c(c(c1Cl)Cl)Cl)Cl)c2c(cc(c(c2Cl)Cl)Cl)Cl -4.6100
CCC[N@@](CC1CC1)c2c(cc(cc2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] -2.4500
CC(=O)O -6.6900
CC=O -3.5000
c1cc(cc(c1)[N+](=O)[O-])N -8.8400
CCCCC#C 0.2900
COc1ccccc1N -6.1200
c1ccc(cc1)O -6.6000
CCC#N -3.8400
c1ccc2c(c1)cccc2O -7.6700
CCCCOC(=O)C -2.6400
CC(C)(/C=N\OC(=O)NC)SC -9.8400
Cc1ccccc1O -5.9000
CC(C)C=O -2.8600
CCC(=O)N -9.4000
CCCBr -0.5600
CC(C)Cl -0.2500
C(CCl)CCl -1.8900
c1cc(ccc1[N+](=O)[O-])O -10.6400
C[C@@H](CCl)Cl -1.2700
c1cc(ccc1N)Cl -5.9000
c1ccc2c(c1)C(=O)c3cccc(c3C2=O)N -9.4400
Cc1cccnc1C -4.8200
c1cnccc1C#N -6.0200
CCOP(=S)(OCC)SCSCC -4.3700
CC(=O)C1CCCCC1 -3.9000
Cc1ccccc1C=O -3.9300
CC(=O)c1ccncc1 -7.6200
c1c2c(cc(c1Cl)Cl)Oc3c(c(c(c(c3Cl)Cl)Cl)Cl)O2 -3.7100
CC(=O)C -3.8000
CC(=C)C 1.1600
c1cc(c(cc1Cl)c2cc(c(c(c2)Cl)Cl)Cl)Cl -3.6100
CCCCC[N+](=O)[O-] -2.8200
CCC/C=C/C=O -3.6800
CN(C)C(=O)c1ccc(cc1)[N+](=O)[O-] -11.9500
C1CCOC1 -3.4700
CCCCCCCC 2.8800
CCCN(CCC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] -3.2500
CC(=CCC[C@](C)(C=C)OC(=O)C)C -2.4900
C[C@@H](CCO[N+](=O)[O-])O[N+](=O)[O-] -4.2900
CC(C)OC(C)C -0.5300
CCCCC(C)C 2.9300
c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)N(=O)=O -5.2200
[C@@H](C(F)(F)F)(Cl)Br -0.1100
CCCCOCCCC -0.8300
CCCCCC1CCCC1 2.5500
CC(C)CC(C)C 2.8300
Cc1ccc(nc1)C -4.7200
C/C=C/C=O -4.2200
CCC[C@H](C)CC 2.7100
c1cc(c(c(c1)Cl)c2c(cc(cc2Cl)Cl)Cl)Cl -1.9600
c1ccc(cc1)O[C@@H](C(F)F)F -1.2900
COCCOC -4.8400
CC[C@H](C)c1ccccc1 -0.4500
c1ccc(cc1)CCCO -6.9200
CC[C@@H](C)c1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-] -6.2300
COc1ccc(cc1)C(=O)OC -5.3300
CCC(=O)Nc1ccc(c(c1)Cl)Cl -7.7800
C[C@@H](c1ccc2cc(ccc2c1)OC)C(=O)O -10.2100
C1(C(C(C1(F)F)(F)F)(F)F)(F)F 3.4300
CC(C)CCOC(=O)C -2.2100
CCCCCCCl 0.0000
CC(C)CC(=O)C -3.0500
CCCCCC=O -2.8100
c1cc(cc(c1)Cl)N -5.8200
C1COCCN1 -7.1700
CCOC(C)OCC -3.2800
CCCC[N@](CC)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] -3.5100
CS -1.2000
C1[C@@H]2[C@H](COS(=O)O1)[C@@]3(C(=C([C@]2(C3(Cl)Cl)Cl)Cl)Cl)Cl -4.2300
CC(=O)c1ccc(cc1)OC -4.4000
C=CCO -5.0300
CCSC -1.5000
CCCCCOC(=O)C -2.5100
c1c(cc(c(c1Cl)Cl)Cl)Cl -1.6200
CC(=O)c1ccccc1 -4.5800
CCCl -0.6300
CCCC1CCCC1 2.1300
c1c(cc(cc1Cl)Cl)Cl -0.7800
CCCOC(=O)c1ccc(cc1)O -9.3700
c1cc(cc(c1)Cl)O -6.6200
CC(C)CCO -4.4200
CCCCCN -4.0900
Cc1c(c(=O)n(c(=O)[nH]1)C(C)(C)C)Cl -11.1400
CC(C)CCC(C)(C)C 2.9300
CCCCOCCO -6.2500
C1[C@@H]2[C@H]3[C@@H]([C@H]1[C@H]4[C@@H]2O4)[C@@]5(C(=C([C@]3(C5(Cl)Cl)Cl)Cl)Cl)Cl -4.8200
c1ccc(cc1)C(=O)N -11.0000
CC(C)[N+](=O)[O-] -3.1300
C(C(CO)O)O -13.4300
CCCI -0.5300
COCCN -6.5500
C(C(Cl)(Cl)Cl)Cl -1.4300
CCC(=O)OC -2.9300
C1CCCC1 1.2000
CCc1cccnc1 -4.5900
Cc1cc(cnc1)C -4.8400
COCCO -6.6200
COC=O -2.7800
c1ccc2cc(ccc2c1)N -7.4700
Cc1c[nH]cn1 -10.2700
Cc1cccc(c1)[N+](=O)[O-] -3.4500
C(CCCl)CCl -2.3200
CC(=O)CO[N+](=O)[O-] -5.9900
CC(C)(C)c1ccccc1 -0.4400
CCCCCC(=O)OC -2.4900
C[C@@H](C(F)(F)F)O -4.1600
CCCCCBr -0.1000
CCCCCCC=C 1.9200
CC1=CC(=O)[C@@H](CC1)C(C)C -4.5100
CC(C)O -4.7400
CCCCCCN -3.9500
C(CO[N+](=O)[O-])CO[N+](=O)[O-] -4.8000
Cc1ccc(c(c1)C)O -6.0100
CCCCCO -4.5700
CCC[C@@H](C)O -4.3900
CCCC[C@@H](C)CC 2.9700
C[C@@H](c1ccc(cc1)CC(C)C)C(=O)O -7.0000
CCOC(=O)C[C@H](C(=O)OCC)SP(=S)(OC)OC -8.1500
Cc1ccc(cc1C)O -6.5000
Cc1cc(ccc1Cl)O -6.7900
CCCC/C=C/C 1.6800
CCCOCCC -1.1600
C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C -3.2000
CCNc1nc(nc(n1)SC)NC(C)(C)C -6.6800
CC(C)CC(C)(C)C 2.8900
CCCCC(=O)CCCC -2.6400
CCCCN(CC)C(=O)SCCC -3.6400
CCCCCC=C 1.6600
CC(C)OC=O -2.0200
CC(OC(=O)C)OC(=O)C -4.9700
c1c(c(=O)[nH]c(=O)[nH]1)Cl -17.7400
CC(=C)c1ccccc1 -1.2400
CCC(C)C 2.3800
CCCCO[N+](=O)[O-] -2.0900
c1ccc(cc1)Br -1.4600
CC(Cl)(Cl)Cl -0.1900
CC(=C)[C@H]1CCC(=CC1)C=O -4.0900
Cc1ccccc1[N+](=O)[O-] -3.5800
CCCCCCCI 0.2700
c1cc2ccc3cccc4c3c2c(c1)cc4 -4.5200
CCCCCCl -0.1000
CC(C)COC(=O)C -2.3600
CCC(C)(C)C 2.5100
c1cc(ccc1N)N(=O)=O -9.8200
COC(=O)CC#N -6.7200
COc1ccc(cc1)N -7.4800
CC(C)Cc1ccccc1 0.1600
c1ccc(cc1)c2c(cc(cc2Cl)Cl)Cl -2.1600
CN -4.5500
c1ccc(c(c1)O)Cl -4.5500
c1ccc2c(c1)C(=O)c3ccc(cc3C2=O)N -11.5300
C(=C\Cl)\Cl -1.1700
CCCCC(=O)C -3.2800
C(CO[N+](=O)[O-])O[N+](=O)[O-] -5.7300
c1ccc(c(c1)O)F -5.2900
Cc1c(nc(nc1OC(=O)N(C)C)N(C)C)C -9.4100
C=Cc1ccccc1 -1.2400
CCOP(=O)(OCC)OCC -7.5000
C(C(F)(F)F)O -4.3100
CCCCOC[C@H](C)O -5.7300
CCCO -4.8500
Cc1ccccc1C -0.9000
CC(C)(C)C 2.5100
CCCC#C 0.0100
c1ccc2c(c1)C(=O)NC2=O -9.6100
CCCCI -0.2500
Cc1ccc(cc1)O -6.1300
CC(C)I -0.4600
COc1ccccc1O -5.9400
C1CC=CC1 0.5600
C[C@H](C(F)(F)F)O -4.2000
CCCN -4.3900
c1ccc(c(c1)[N+](=O)[O-])O -4.5800
Cc1cccc2c1cccc2 -2.4400
c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)Cl -2.3300
CCCCC/C=C/C=O -3.4300
CCCCCCC#C 0.7100
CCOP(=S)(OCC)Oc1cc(nc(n1)C(C)C)C -6.4800
CCCCCCCC(=O)OC -2.0400
C1CCNC1 -5.4800
c1cc(ccc1C=O)O -8.8300
CCCCCCCCl 0.2900
C1COCCO1 -5.0600
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