UCSF

ZINC34827490

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 10 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) -1.26 -6.38 -5.73 3 4 0 70 166.198 0
Hi High (pH 8-9.5) -1.26 -5.84 -41.61 3 4 -1 70 165.19 0

Activity (Go SEA)

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