UCSF

ZINC41584321

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 30 No

Popular Name: (2E)-7-[[bis(2-methoxyethyl)amino]methyl]-2-[(3-bromophenyl)methylene]-6-hydroxy-4-methyl-benzofuran (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) 4.06 6.16 -8.05 1 6 0 72 476.367 9 ↓
Hi High (pH 8-9.5) 4.06 6.92 -45.96 0 6 -1 75 475.359 9 ↓
Mid Mid (pH 6-8) 4.06 9.13 -32.87 1 6 0 76 476.367 9 ↓
Mid Mid (pH 6-8) 4.06 8.39 -39.28 2 6 1 73 477.375 9 ↓

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