UCSF

ZINC01678932

Substance Information

In ZINC since Heavy atoms Benign functionality
December 31st, 2005 12 Yes

Other Names:

MFCD20488764

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) 1.99 -0.1 -7.82 1 2 0 28 158.204 2

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 98% Fluorochem
PUBCHEM_PATENT_ID US6124484; WO2000004062A1 IBM Patent Data

Activity (Go SEA)

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