UCSF

ZINC23070854

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2008 11 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) 0.92 1.93 -43.02 3 2 1 31 157.281 3
Mid Mid (pH 6-8) 0.92 4.05 -25.96 3 2 1 30 157.281 3
Mid Mid (pH 6-8) 0.92 3.74 -115.03 4 2 2 32 158.289 3

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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