UCSF

ZINC03918159

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 18th, 2005 28 No

Popular Name: Hyodeoxycholic acid sodium salt Hyodeoxycholic acid sodium salt

Find On: PubMed — Wikipedia — Google

CAS Numbers: 10421-49-5 , 31687-62-4 , 83-49-8 , [10421-49-5] , [83-49-8]

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 6.13 -50.27 2 4 -1 80 391.572 4 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 197-199? Alfa-Aesar
Melting_Point 197-199° Alfa-Aesar
UniProt Database Links CP3A4_HUMAN; CP4AL_PIG ChEBI
PUBCHEM_PATENT_ID EP0034366A2; EP0034367A2; EP0034368A2; EP0168229A2; EP0168229B1; EP0281463A2; EP0293751A2; EP0293751B1; EP0488513A2; EP0488513B1; EP0490944A1; EP0490944B1; EP0491778A1; EP0491778B1; EP0676410B1; EP0742203A3; EP0742203B1; EP0767666A1; EP0794175A2; EP083183 IBM Patent Data
Target Others Selleck Chemicals
UniProt Database Links UD2B4_HUMAN; UD2B7_HUMAN; UD2B7_RAT; UDB23_MACFA; UDB33_MACMU ChEBI

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )