UCSF

ZINC23949826

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 21 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) 5.15 6.66 -8.67 0 4 0 52 339.873 4

Activity (Go SEA)

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