UCSF

ZINC49786118

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2010 16 Yes

Popular Name: 2-(1-piperidyl)-2-(p-tolyl)acetonitrile 2-(1-piperidyl)-2-(p-tolyl)aceto…

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CAS Numbers: 1440535-49-8 , 42419-52-3

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) 3.07 7.27 -4.75 0 2 0 27 214.312 2 ↓

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