UCSF

ZINC49573691

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 19 Yes

Popular Name: (2R)-2-(azepan-1-yl)-2-(4-hydroxy-3-methoxy-phenyl)acetonitrile (2R)-2-(azepan-1-yl)-2-(4-hydrox…

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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) 2.46 4.53 -7.35 1 4 0 56 260.337 3 ↓

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