UCSF

ZINC03830788

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2005 24 No

Popular Name: ESTROPIPATE ESTROPIPATE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 12126-59-9 , 481-97-0 , 7280-37-7

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) 0.84 6.2 -50.04 0 5 -1 84 349.428 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0748190A1 IBM Patent Data
Therapy estrogen SMDC Pharmakon

Activity (Go SEA)

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