UCSF

ZINC03884499

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 12 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) 2.49 -0.4 -6.7 2 4 0 72 231.049 1

Vendor Notes

Note Type Comments Provided By
melting_point 170 - 172 KeyOrganics
MP 170-172° Matrix Scientific
MP 177-183° Oakwood Chemical
Purity 98% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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