UCSF

ZINC25497721

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 26 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) 4.67 11.59 -51.5 2 6 -1 98 368.8 5
Hi High (pH 8-9.5) 5.12 9.99 -134.37 1 6 -2 101 367.792 5

Activity (Go SEA)

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