UCSF

ZINC34984709

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 34 Yes

Popular Name: N-(2-chlorophenyl)-1-methyl-5-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridyl]oxy]benzimidazol- N-(2-chlorophenyl)-1-methyl-5-[[…

Find On: PubMed — Wikipedia — Google

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) 6.21 13.41 -10.24 2 7 0 81 484.869 6 ↓
Hi High (pH 8-9.5) 6.21 13.03 -44.23 1 7 -1 79 483.861 6 ↓
Lo Low (pH 4.5-6) 6.21 13.55 -35.41 3 7 1 82 485.877 6 ↓
Lo Low (pH 4.5-6) 6.21 14.11 -87.85 4 7 2 83 486.885 6 ↓

Activity (Go SEA)

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