UCSF

ZINC01845945

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 15 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) 4.83 1.2 -3.22 1 1 0 12 197.281 2

Vendor Notes

Note Type Comments Provided By
BP 330 TCI
MP 78-82° Matrix Scientific
MP 79 TCI
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 98% APIChem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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