UCSF

ZINC33823682

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 29 Yes

Popular Name: 1-Piperidineacetamide, N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-; BRN 0501144; LS-114046; N-(4-(1,2,3,4-Tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-1-piperidineacetamide 1-Piperidineacetamide, N-(4-(1,2…

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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) 4.04 9.84 -46.2 3 5 1 63 392.523 4 ↓
Hi High (pH 8-9.5) 4.04 7.67 -16.12 2 5 0 61 391.515 4 ↓

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