UCSF

ZINC02572444

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 29 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) 3.34 1.39 -54.03 1 7 -1 104 394.403 10

Vendor Notes

Note Type Comments Provided By
MP 113-114o C Indofine
Purity 95% Fluorochem
Purity 99%min APIChem

Activity (Go SEA)

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