UCSF

ZINC31773258

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2009 27 No

Popular Name: 5-[(4-Bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide 5-[(4-Bromo-2-chlorophenyl)amino…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 606143-52-6 , 943332-08-9 , [606143-52-6]

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) 3.42 6.81 -25.34 3 7 0 88 457.687 6 ↓
Ref Reference (pH 7) 3.49 5.24 -13.42 3 7 0 92 457.687 6 ↓
Lo Low (pH 4.5-6) 3.42 7.25 -59.59 4 7 1 90 458.695 6 ↓
Lo Low (pH 4.5-6) 3.49 5.72 -43.86 4 7 1 93 458.695 6 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Target MEK Selleck Chemicals

Activity (Go SEA)

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