UCSF

ZINC35994563

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2009 19 Yes

Popular Name: 4-[(2S)-2-methyl-1-piperidyl]-2-(trifluoromethyl)benzonitrile 4-[(2S)-2-methyl-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) 3.86 8.74 -5.77 0 2 0 27 268.282 2 ↓

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