UCSF

ZINC41584872

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 36 No

Popular Name: (2Z)-7-[(4-benzylpiperazin-1-yl)methyl]-2-[(4-dimethylaminophenyl)methylene]-6-hydroxy-4-methyl-benz (2Z)-7-[(4-benzylpiperazin-1-yl)…

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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) 4.70 11.98 -44.73 2 6 1 61 484.62 6 ↓
Hi High (pH 8-9.5) 4.70 10.27 -45.82 0 6 -1 63 482.604 6 ↓
Mid Mid (pH 6-8) 4.70 12.52 -30.05 1 6 0 64 483.612 6 ↓
Mid Mid (pH 6-8) 4.70 9.67 -10.22 1 6 0 60 483.612 6 ↓
Mid Mid (pH 6-8) 4.70 11.91 -46.29 2 6 1 61 484.62 6 ↓
Lo Low (pH 4.5-6) 4.70 12.73 -100.85 3 6 0 63 485.628 6 ↓

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