UCSF

ZINC41514145

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 31 No

Popular Name: (2Z)-2-[(4-dimethylaminophenyl)methylene]-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benz (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) 2.29 5.08 -44.46 3 7 1 82 424.521 6 ↓
Hi High (pH 8-9.5) 2.29 3.38 -48.01 1 7 -1 83 422.505 6 ↓
Mid Mid (pH 6-8) 2.29 5.13 -43.11 3 7 1 82 424.521 6 ↓
Mid Mid (pH 6-8) 2.29 2.82 -11.51 2 7 0 80 423.513 6 ↓
Mid Mid (pH 6-8) 2.29 5.62 -32.69 2 7 0 84 423.513 6 ↓
Lo Low (pH 4.5-6) 2.29 5.83 -107.51 4 7 0 83 425.529 6 ↓

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