UCSF

ZINC43179964

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 8th, 2010 24 Yes

Popular Name: N-(1-methyl-4-piperidyl)-4-[2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethyl]piperazine-1-carboxamide N-(1-methyl-4-piperidyl)-4-[2-[[…

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Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

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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) 1.67 4.63 -48 3 7 1 69 340.492 5 ↓
Mid Mid (pH 6-8) 1.67 6.8 -95.3 4 7 2 70 341.5 5 ↓

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