UCSF

ZINC43404746

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 13 Yes

Popular Name: 2-chloro-6-[(1S)-1-methylpropyl]pyridine-3-carbonitrile 2-chloro-6-[(1S)-1-methylpropyl]…

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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) 2.88 5.93 -6.94 0 2 0 37 194.665 2 ↓

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