UCSF

ZINC38854048

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2010 25 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) 2.15 7.55 -53.77 3 5 1 68 409.348 4

Activity (Go SEA)

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