UCSF

ZINC26895199

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 25 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) 2.25 4.1 -18.9 2 6 0 89 357.387 4
Hi High (pH 8-9.5) 2.25 4.88 -62.53 1 6 -1 92 356.379 4

Activity (Go SEA)

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