UCSF

ZINC62850746

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 15th, 2011 20 Yes

Popular Name: N-methyl-N-[(4-propyl-4-piperidyl)methyl]-2-(4-pyridyl)ethanamine N-methyl-N-[(4-propyl-4-piperidy…

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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) 2.20 8.46 -115.65 3 3 2 34 277.456 7 ↓
Hi High (pH 8-9.5) 2.20 6.91 -42.07 2 3 1 33 276.448 7 ↓

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

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