UCSF

ZINC04082064

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2005 28 No

Popular Name: Chenodeoxycholic acid Chenodeoxycholic acid

Find On: PubMed — Wikipedia — Google

CAS Number: 474-25-9

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 4.25 -2.36 -50.03 2 4 -1 80 391.572 4 ↓

Vendor Notes

Note Type Comments Provided By
M.P 165-167 °C Indofine
Purity 95% Fluorochem
SOLUBILITY PRACTICALLY INSOLUBLE Indofine
PUBCHEM_PATENT_ID WO1999058549A1 IBM Patent Data

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