Chemoinformaics analysis of POTASSIUM-SUCCINATE


Molecular Weight 194.268 nRot 3
Heavy Atom Molecular Weight 190.236 nRig 2
Exact Molecular Weight 193.938 nRing 0
Solubility: LogS -0.064 nHRing 0
Solubility: LogP -2.81 No. of Aliphatic Rings 0
Acid Count 2 No. of Aromatic Rings 0
Base Count 2 No. of Aliphatic Carbocycles Rings 0
Atoms Count 14 No. of Aliphatic Hetero Cycles 0
No. of Heavy Atom 10 No. of Aromatic Carbocycles 0
nHetero 6 No. of Aromatic Hetero Cycles 0
nBridge Head 0 No. Saturated Carbocycles 0
No. of Hydrogen atom 4 No. of Saturated Hetero Cycles 0
No. of Carbon atom 4 No. of Saturated Rings 0
No. of Nitrogen atom 0 No. of Arom Atom 0
No. of Oxygen atom 4 No. of Arom Bond 0
nHA 4 APOL 98.6752
nHD 0 BPOL 7.48483
QED 0.4
Synth 4.45
Natural Product Likeliness -0.183
NR-PPAR-gamma 0.031
Lipinski Accepted
Pfizer Accepted
GSK Accepted
Golden Triangle Rejected
Pgp-inh 0.004
Pgp-sub 0
HIA 0.005
CACO-2 -4.852
MDCK 0.00017706
BBB 0.464
PPB 0.24139
VDSS 0.224
FU 0.746198
CYP1A2-inh 0.005
CYP1A2-sub 0.047
CYP2c19-inh 0.02
CYP2c19-sub 0.054
CYP2c9-inh 0.006
CYP2c9-sub 0.913
CYP2d6-inh 0.007
CYP2d6-sub 0.082
CYP3a4-inh 0.003
CYP3a4-sub 0.016
CL 1.589
T12 0.556
hERG 0.006
Ames 0.068
ROA 0.017
SkinSen 0.683
Carcinogencity 0.143
EI 0.955
Respiratory 0.021
NR-Aromatase 0.002
Antiviral Yes
Prediction 0.615964