UCSF

ZINC41584341

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 29 No

Popular Name: (2E)-7-[[bis(2-methoxyethyl)amino]methyl]-6-hydroxy-4-methyl-2-(2-pyridylmethylene)benzofuran-3-one (2E)-7-[[bis(2-methoxyethyl)amin…

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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) 2.10 6.46 -12.74 1 7 0 85 398.459 9 ↓
Hi High (pH 8-9.5) 2.10 5.68 -53.29 0 7 -1 88 397.451 9 ↓
Mid Mid (pH 6-8) 2.10 7.11 -40.72 2 7 1 86 399.467 9 ↓
Mid Mid (pH 6-8) 2.10 7.9 -38.17 1 7 0 89 398.459 9 ↓

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