UCSF

ZINC01436151

Substance Information

In ZINC since Heavy atoms Benign functionality
August 17th, 2004 14 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) 1.25 1.94 -8.81 1 4 0 50 201.266 3

Vendor Notes

Note Type Comments Provided By
Boiling_Point 285-289? Alfa-Aesar
Boiling_Point 285-291? Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 96% Matrix Scientific
PUBCHEM_PATENT_ID EP0900797A1; US5977097 IBM Patent Data
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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