UCSF

ZINC34957496

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 19 No

Popular Name: 2-[[(3S)-3-piperidyl]methyl]-4H-isoquinoline-1,3-dione 2-[[(3S)-3-piperidyl]methyl]-4H-…

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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) 0.43 6.14 -40.87 2 4 1 54 259.329 2 ↓

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