UCSF

ZINC20614265

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 26th, 2008 33 Yes

Popular Name: N-[(2S)-2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-3,4,5-trimethoxy-benzamide N-[(2S)-2-(1,3-benzodioxol-5-yl)…

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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) 2.16 5.61 -53.68 2 9 1 83 458.535 8 ↓
Mid Mid (pH 6-8) 2.16 5.6 -52.64 2 9 1 83 458.535 8 ↓
Mid Mid (pH 6-8) 2.16 3.22 -14.29 1 9 0 82 457.527 8 ↓

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