UCSF

ZINC41513959

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Substance Information

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

Popular Name: (2Z)-2-[(4-dimethylaminophenyl)methylene]-6-hydroxy-7-[(4-methylpiperazin-1-yl)methyl]benzofuran-3-o (2Z)-2-[(4-dimethylaminophenyl)m…

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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) 2.92 7.41 -43.13 2 6 1 61 394.495 4 ↓
Hi High (pH 8-9.5) 2.92 5.77 -45.04 0 6 -1 63 392.479 4 ↓
Hi High (pH 8-9.5) 2.92 8.14 -54.67 1 6 0 64 393.487 4 ↓
Hi High (pH 8-9.5) 2.92 5.05 -9.2 1 6 0 60 393.487 4 ↓
Lo Low (pH 4.5-6) 2.92 8.19 -120.91 3 6 0 63 395.503 4 ↓

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