UCSF

ZINC34165681

Substance Information

In ZINC since Heavy atoms Benign functionality
August 12th, 2009 25 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) -0.78 -2 -26.32 5 11 0 163 353.335 4
Mid Mid (pH 6-8) -0.32 -3.83 -71.8 4 11 -1 166 352.327 4

Vendor Notes

Note Type Comments Provided By
MP 148 TCI
Purity 95% Fluorochem
Purity 97% Fluorochem

Activity (Go SEA)

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