UCSF

ZINC25760850

Substance Information

In ZINC since Heavy atoms Benign functionality
February 1st, 2009 28 No

Download: MOL2 SDF SMILES Flexibase

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) 0.89 1.38 -16.48 3 12 0 150 389.42 5
Mid Mid (pH 6-8) 0.89 3.71 -48.34 4 12 1 151 390.428 5

Activity (Go SEA)

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