UCSF

ZINC31881412

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Substance Information

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

Popular Name: Benzenemethanol, alpha-(((4,6-dimethyl-2-pyridinyl)amino)methyl)-, hydrochloride; Benzyl alcohol, alpha-(((4,6-dimethyl-2-pyridyl)amino)methyl)-, hydrochloride; LS-42960; alpha-(((4,6-Dimethyl-2-pyridyl)amino)methyl)benzyl alcohol hydrochloride Benzenemethanol, alpha-(((4,6-di…

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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) 2.55 5.59 -27.19 3 3 1 46 243.33 4 ↓
Hi High (pH 8-9.5) 2.55 5.15 -6.64 2 3 0 45 242.322 4 ↓

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