UCSF

ZINC06484986

Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2006 24 Yes

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) 4.89 -1.55 -10.49 2 4 0 58 341.794 4

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
DPOL-4-V Human Herpesvirus 6 DNA Polymerase (cluster #4 Of 4), Viral Viruses 760 0.36 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
DPOL_HHV6U P28857 Human Herpesvirus 6 DNA Polymerase, Hhv6u 760 0.36 Binding ≤ 1μM
DPOL_HHV6U P28857 Human Herpesvirus 6 DNA Polymerase, Hhv6u 760 0.36 Binding ≤ 10μM

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