UCSF

ZINC09419985

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 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) 4.06 -0.76 -44.27 1 4 1 35 317.416 3

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
Z50651-1-O Vesicular Stomatitis Virus (cluster #1 Of 2), Other Other 4074 0.31 Functional ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
Z50651 Z50651 Vesicular Stomatitis Virus 1318.25674 0.34 Functional ≤ 10μM

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