UCSF

ZINC00158261

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 10 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) -0.01 2.58 -99.93 4 2 2 32 142.246 0

Vendor Notes

Note Type Comments Provided By
MP 124-125° Matrix Scientific
BP 82°/6mm Fluorochem
BP 82°/8mm Matrix Scientific
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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