UCSF

ZINC34684346

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2009 29 Yes

Popular Name: 2-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-N-[(1S)-1-methylpropyl]oxazole-4-carboxamid 2-[[4-(1,3-benzodioxol-5-ylmethy…

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Annotations

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Vendors

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) 2.09 3.73 -50.36 2 8 1 81 401.487 7 ↓
Mid Mid (pH 6-8) 2.09 3.75 -48.07 2 8 1 81 401.487 7 ↓
Mid Mid (pH 6-8) 2.09 1.48 -10.72 1 8 0 80 400.479 7 ↓

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