UCSF

ZINC36886409

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2009 18 Yes

Popular Name: (3S)-1-(4-cyano-2-fluoro-phenyl)piperidine-3-carboxamide (3S)-1-(4-cyano-2-fluoro-phenyl)…

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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) 1.39 4.4 -12.27 2 4 0 70 247.273 2 ↓

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