UCSF

ZINC00017537

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Popular Name: 4-(4-chlorophenyl)-2-phenyl-1H-imidazole 4-(4-chlorophenyl)-2-phenyl-1H-i…

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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) 4.39 9.09 -7.05 1 2 0 29 254.72 2 ↓
Mid Mid (pH 6-8) 4.39 0.37 -33.57 2 2 1 29 255.728 2 ↓
Mid Mid (pH 6-8) 4.39 9.11 -9.03 1 2 0 29 254.72 2 ↓
Lo Low (pH 4.5-6) 4.39 9.52 -32.98 2 2 1 30 255.728 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0996443A1; US5498301; US5560785; US6121260; WO1999001128A1 IBM Patent Data

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