UCSF

ZINC59533847

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2011 26 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) 1.27 9.96 -55.26 1 5 -1 78 372.466 10
Hi High (pH 8-9.5) 1.27 10.49 -122.99 1 5 -2 78 371.458 10

Activity (Go SEA)

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