UCSF

ZINC37083165

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 21 Yes

Popular Name: (1R)-2-[(2S)-2-ethyl-1-piperidyl]-1-(1-naphthyl)ethanamine (1R)-2-[(2S)-2-ethyl-1-piperidyl…

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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) 2.39 9.67 -36.56 3 2 1 30 283.439 4 ↓
Mid Mid (pH 6-8) 2.39 9.98 -134.2 4 2 2 32 284.447 4 ↓

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