UCSF

ZINC00402900

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 20 No

Popular Name: Equilin Equilin

Find On: PubMed — Wikipedia — Google

CAS Number: 474-86-2

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) 2.81 7.11 -7.47 1 2 0 37 268.356 0 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.33e-02 g/l DrugBank-experimental
Patent Database Links EP1862167 ChEBI
Therapy estrogen SMDC Pharmakon

Activity (Go SEA)

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