UCSF

ZINC03938704

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2005 39 No

Popular Name: Epirubicin Epirubicin

Find On: PubMed — Wikipedia — Google

CAS Numbers: 56390-09-1 , 56420-45-2 , [56390-09-1]

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) 0.57 -10.9 -56.25 8 12 1 207 544.533 5 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.18e+00 g/l DrugBank-approved
therap antineoplastic MicroSource Spectrum
PUBCHEM_PATENT_ID EP0030295A1; EP0253654A2; EP0265719A1; EP0265719B1; EP0273603A2; EP0273603B1; EP0280167A2; EP0282160A2; EP0282160B1; EP0290296A2; EP0290296B1; EP0290744A2; EP0290744B1; EP0294294A2; EP0294294B1; EP0297946A2; EP0316776B1; EP0328147A2; EP0328147B1; EP032918 IBM Patent Data
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : Sequoia Research Products Ltd.; NCC_SUPPLIER_STRUCTURE_ID : SRP01310e; 1 hydrogen chloride NIH Clinical Collection via PubChem
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: Sequoia Research Products Ltd.; SUPPLIER_STRUCTURE_ID: SRP01310e; SALT: 1 hydrogen chloride NIH Clinical Collection via PubChem

Activity (Go SEA)

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