UCSF

ZINC03874807

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 22 Yes

Popular Name: 5,7-Dihydroxy-3-(4-hydroxyphenyl)-8-methoxy-4H-chromen-4-one 5,7-Dihydroxy-3-(4-hydroxyphenyl…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 13111-57-4 , [13111-57-4]

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) 2.28 1.93 -16.83 3 6 0 100 300.266 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0809493A1; US5610185; WO1996025159A1; WO1997043643A1; WO2000053771A1 IBM Patent Data

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