OSADHI - Online Structural and Analytics based Database for Herbs of India

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Chemoinformaics analysis of MURAMIDASE


Physiochemical Properties
Molecular Weight 2899.32 nRot 96
Heavy Atom Molecular Weight 2701.75 nRig 56
Exact Molecular Weight 2897.42 nRing 4
Solubility: LogS -0.865 nHRing 1
Solubility: LogP -3.376 No. of Aliphatic Rings 0
Acid Count 3 No. of Aromatic Rings 4
Base Count 11 No. of Aliphatic Carbocycles Rings 0
Atoms Count 399 No. of Aliphatic Hetero Cycles 0
No. of Heavy Atom 203 No. of Aromatic Carbocycles 3
nHetero 78 No. of Aromatic Hetero Cycles 1
nBridge Head 0 No. Saturated Carbocycles 0
No. of Hydrogen atom 196 No. of Saturated Hetero Cycles 0
No. of Carbon atom 125 No. of Saturated Rings 0
No. of Nitrogen atom 40 No. of Arom Atom 23
No. of Oxygen atom 36 No. of Arom Bond 23
nHA 41 APOL 418.113
nHD 46 BPOL 241.269
Medicinal Chemistry Properties
QED 0.008
Synth 9.037
Natural Product Likeliness 0.126
NR-PPAR-gamma 0
Drug Likeliness
Lipinski Rejected
Pfizer Accepted
GSK Rejected
Golden Triangle Rejected
Absorption
Pgp-inh 0
Pgp-sub 0.993
HIA 1
CACO-2 -9.751
Distribution
MDCK 0.000000374
BBB 0
PPB 0.283657
VDSS 0.356
Metabolism
FU 0.30108
CYP1A2-inh 0
CYP1A2-sub 0
CYP2c19-inh 0
CYP2c19-sub 0.001
CYP2c9-inh 0.004
CYP2c9-sub 0
CYP2d6-inh 0
CYP2d6-sub 0.001
CYP3a4-inh 0
CYP3a4-sub 0
Excretion
CL -2.254
T12 0.823
Toxicity
hERG 0
Ames 0
ROA 0.799
SkinSen 0.003
Carcinogencity 0
EI 0
Respiratory 0
NR-Aromatase 0
Antiviral Prediction
Antiviral Yes
Prediction 0.873638
OSADHI

A database of all the medicinal plants having PAN India presence.
Hosted at CSIR-North East Institute of Science and Technology, Jorhat

Our Other Tools

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