UCSF

ZINC06355949

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 20 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) 1.79 2.78 -36.64 4 4 1 66 280.388 8
Hi High (pH 8-9.5) 1.79 1.52 -8.02 3 4 0 62 279.38 8

Activity (Go SEA)

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