UCSF

ZINC00154200

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 13 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) 0.79 2.68 -54.31 0 4 -1 66 173.151 1

Vendor Notes

Note Type Comments Provided By
MP 270-274° (dec.) Oakwood Chemical
MP 290° (dec.) Fluorochem
MP 290°(dec) Matrix Scientific
Purity 95% Fluorochem
Warnings Irritant Matrix Scientific

Activity (Go SEA)

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