UCSF

ZINC13209241

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 12th, 2008 17 Yes

Popular Name: 3-(((alpha-Methylphenethyl)amino)methyl)pyridine maleate; BS-25; LS-131820; Pyridine, 3-(((alpha-methylphenethyl)amino)methyl)-, maleate (1:1) 3-(((alpha-Methylphenethyl)amino…

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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) 2.39 7.82 -40.2 2 2 1 29 227.331 5 ↓
Mid Mid (pH 6-8) 2.39 6.62 -4.2 1 2 0 25 226.323 5 ↓

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

No pre-computed analogs available. Try a structural similarity search.