UCSF

ZINC29561853

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2009 20 No

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) 6.46 9.1 -43.59 1 3 -1 52 532.91 2
Mid Mid (pH 6-8) 6.46 8.29 -11.7 2 3 0 49 533.918 2

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
POLG-2-V Genome Polyprotein (cluster #2 Of 3), Viral Viruses 8600 0.35 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
POLG_HCVBK P26663 Genome Polyprotein, Hcvbk 8600 0.35 Binding ≤ 10μM

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