UCSF

ZINC42795853

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2010 20 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) -0.13 4.86 -51.59 2 5 1 57 294.297 4
Hi High (pH 8-9.5) -0.13 3.6 -5.89 1 5 0 53 293.289 4

Activity (Go SEA)

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