UCSF

ZINC49256744

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 18 Yes

Popular Name: N-[(2,5-dimethylphenyl)methyl]-2-(4-pyridyl)ethanamine N-[(2,5-dimethylphenyl)methyl]-2…

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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) 2.84 7.13 -5.07 1 2 0 25 240.35 5 ↓
Mid Mid (pH 6-8) 2.84 7.59 -33.71 2 2 1 26 241.358 5 ↓

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

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