UCSF

ZINC40141455

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 22 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.87 9.42 -43.71 2 5 1 60 307.414 10

Activity (Go SEA)

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