UCSF

ZINC02090814

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2005 27 Yes

Popular Name: 1-[2-(3-pyridyl)-1-piperidyl]-2-(trimethylBLAHyl)-ethanone 1-[2-(3-pyridyl)-1-piperidyl]-2-…

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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) 2.56 0.21 -14.5 0 5 0 51 364.493 3 ↓
Lo Low (pH 4.5-6) 2.56 0.32 -32.6 1 5 1 52 365.501 3 ↓

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Rings

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