UCSF

ZINC00154150

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 16 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) 0.21 0.91 -51.74 2 4 1 54 241.336 2

Vendor Notes

Note Type Comments Provided By
BP 136-138° Matrix Scientific
MP 148-150° Matrix Scientific
Purity 95%+ Fluorochem
Warnings Irritant Matrix Scientific

Activity (Go SEA)

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