UCSF

ZINC41584964

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 38 Yes

Popular Name: 8-[(4-benzylpiperazin-1-yl)methyl]-7-hydroxy-3-(4-methoxyphenyl)-2-(trifluoromethyl)chromen-4-one 8-[(4-benzylpiperazin-1-yl)methy…

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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) 5.72 10.96 -46.01 2 6 1 67 525.547 7 ↓
Hi High (pH 8-9.5) 5.72 9.24 -38.54 0 6 -1 69 523.531 7 ↓
Mid Mid (pH 6-8) 5.72 8.66 -9.37 1 6 0 66 524.539 7 ↓
Mid Mid (pH 6-8) 5.72 10.92 -47.22 2 6 1 67 525.547 7 ↓

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