UCSF

ZINC00225592

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

Popular Name: 1-benzyl-2-methyl-benzimidazole 1-benzyl-2-methyl-benzimidazole

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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) 3.18 9.36 -9.73 0 2 0 18 222.291 2 ↓
Lo Low (pH 4.5-6) 3.18 9.8 -28.56 1 2 1 19 223.299 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0468971A1; US5314880; US5670526 IBM Patent Data

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