UCSF

ZINC04095972

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 25 No

Popular Name: 3-Oxo-hydroxysteroid; C02942 3-Oxo-hydroxysteroid; C02942

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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) 1.88 6.01 -15.77 2 4 0 75 346.467 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0033341A1; EP0238545A1; EP0238545B1; EP0263213A1; EP0263213B1; US4013688; US4076930; US4283394; US4296233; US5099019; US5175281; US5268477; US5322943; US5380839; US5380840; US5382661; US5506354 IBM Patent Data
PUBCHEM_PATENT_ID EP0175540A2; US4568492 IBM Patent Data
PUBCHEM_PATENT_ID US4150126 IBM Patent Data

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