UCSF

ZINC33816075

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 22 No

Popular Name: (2R,3R,4R,5R)-5-(hydroxymethyl)-2-[6-[hydroxy(methyl)amino]purin-9-yl]-3-methyl-tetrahydrofuran-3,4- (2R,3R,4R,5R)-5-(hydroxymethyl)-…

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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) -1.06 -4.03 -20.39 4 10 0 137 311.298 3 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50643-2-O Hepatitis C Virus (cluster #2 Of 5), Other Other 4000 0.34 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50643 Z50643 Hepatitis C Virus 4000 0.34 Functional ≤ 10μM

Rings

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