UCSF

ZINC33825886

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 24 Yes

Popular Name: L-Threonine, N-((5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)-, (R)-; LS-153750; N-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)threonine L-Threonine, N-((5-chloro-3,4-di…

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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) -0.34 3.5 -60.87 3 8 -1 136 356.738 4 ↓
Hi High (pH 8-9.5) -0.34 4.82 -129.48 2 8 -2 139 355.73 4 ↓

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