UCSF

ZINC20761744

Substance Information

In ZINC since Heavy atoms Benign functionality
November 28th, 2008 24 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) 3.24 7.74 -63.04 3 5 1 76 334.436 8

Activity (Go SEA)

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