UCSF

ZINC31555198

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 18 Yes

Popular Name: DL-1-(p-Chloro-1-phenethyl)imidazole-5-carboxylic acid methyl ester hydrochloride; DL-1-(p-Chloro-alpha-methylbenzyl)imidazole-5-carboxylic acid methyl ester hydrochloride; Imidazole-5-carboxylic acid, 1-(p-chloro-alpha-methylbenzyl)-, methyl ester, hydro DL-1-(p-Chloro-1-phenethyl)imida…

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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) 2.70 8.68 -8.71 0 4 0 44 264.712 4 ↓
Lo Low (pH 4.5-6) 2.70 9.19 -39.77 1 4 1 45 265.72 4 ↓

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