UCSF

ZINC67173987

Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2011 12 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) 1.90 2 -46.14 3 2 1 37 184.646 1
Mid Mid (pH 6-8) 1.90 1.6 -4.08 2 2 0 35 183.638 1

Vendor Notes

Note Type Comments Provided By
MP 198-200° Oakwood Chemical
Purity 95% Fluorochem

Activity (Go SEA)

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