UCSF

ZINC06670792

Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2006 24 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) 3.05 11.27 -46.87 2 3 1 37 347.479 8
Hi High (pH 8-9.5) 3.05 9.9 -8.55 1 3 0 32 346.471 8

Activity (Go SEA)

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