UCSF

ZINC41514643

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 29 No

Popular Name: (2Z)-7-[[benzyl(methyl)amino]methyl]-6-hydroxy-4-methyl-2-(2-pyridylmethylene)benzofuran-3-one (2Z)-7-[[benzyl(methyl)amino]met…

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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) 3.54 10.43 -43.85 2 5 1 68 387.459 5 ↓
Hi High (pH 8-9.5) 3.54 8.87 -48.07 0 5 -1 69 385.443 5 ↓
Mid Mid (pH 6-8) 3.54 8.1 -10.65 1 5 0 67 386.451 5 ↓
Mid Mid (pH 6-8) 3.54 11.21 -30.18 1 5 0 71 386.451 5 ↓

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