UCSF

ZINC26507865

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 19 Yes

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) 1.85 3.8 -11.84 1 6 0 77 253.265 3
Ref Reference (pH 7) 1.85 3.82 -9.36 1 6 0 77 253.265 3

Activity (Go SEA)

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