UCSF

ZINC00026301

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 21 No

Popular Name: 16alpha-Hydroxyestrone 16alpha-Hydroxyestrone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 566-76-7 , [566-76-7]

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) 2.33 3.78 -7.98 2 3 0 58 286.371 0 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO1997011374A1 IBM Patent Data

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