UCSF

ZINC28958204

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2009 41 No

Popular Name: [[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(cyclohexoxycarbonyloxymethoxy)phosphoryl]oxymet [[(1R)-2-(6-aminopurin-9-yl)-1-m…

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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) 3.39 13.35 -24.01 2 15 0 185 599.578 17 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50606-1-O Hepatitis B Virus (cluster #1 Of 3), Other Other 5940 0.18 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50606 Z50606 Hepatitis B Virus 5940 0.18 Functional ≤ 10μM

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