UCSF

ZINC02559930

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 28 No

Popular Name: Isoursodeoxycholic acid Isoursodeoxycholic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 128-13-2 , 78919-26-3

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 -2.31 -49.29 2 4 -1 80 391.572 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 201-204? Alfa-Aesar
Melting_Point 201-204° Alfa-Aesar
UniProt Database Links HCD2_DROME; HCD2_HUMAN ChEBI
PUBCHEM_PATENT_ID WO1999061481A1 IBM Patent Data

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