UCSF

ZINC25102945

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2009 27 Yes

Popular Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(3-cyanophenyl)methyl]-N-methyl-acetamide 2-[(1S)-2-acetyl-1H-isoquinolin-…

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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) 2.06 12.85 -15.49 0 5 0 64 359.429 4 ↓

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