UCSF

ZINC02140839

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 20 No

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) 4.68 3.64 -8.47 0 1 0 17 274.241 2

Vendor Notes

Note Type Comments Provided By
Mp [°C] 83 - 86 Acros Organics
MP 85 TCI
MP 85° Fluorochem
Purity 98% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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