UCSF

ZINC03960893

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2005 48 No

Popular Name: Icariin Icariin

Find On: PubMed — Wikipedia — Google

CAS Number: 489-32-7

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) 1.67 -16.29 -20.18 8 15 0 238 676.668 9 ↓

Vendor Notes

Note Type Comments Provided By
biological_use Antineoplastic agent IBScreen Bioactives
mechanism Calcium regulator IBScreen Bioactives
PUBCHEM_PATENT_ID EP0086233A1; EP0742012A2; US4528188; US6123944; WO1999047137A1; WO2000059520A1; WO2000078323A1 IBM Patent Data
therap hepatoprotective MicroSource Spectrum
biological_use Immunostimulant IBScreen Bioactives IBScreen Bioactives
PUBCHEM_SUBSTANCE_COMMENT NCC_SAMPLE_SUPPLIER : Sequoia Research Products Ltd.; NCC_SUPPLIER_STRUCTURE_ID : SRP00325i NIH Clinical Collection via PubChem
mechanism Neuronal injury inhibitor IBScreen Bioactives IBScreen Bioactives
PUBCHEM_SUBSTANCE_COMMENT SAMPLE_SUPPLIER: Sequoia Research Products Ltd.; SUPPLIER_STRUCTURE_ID: SRP00325i NIH Clinical Collection via PubChem

Activity (Go SEA)

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