UCSF

ZINC41514539

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 32 No

Popular Name: (2Z)-7-[[benzyl(methyl)amino]methyl]-6-hydroxy-2-[(4-isopropylphenyl)methylene]-4-methyl-benzofuran- (2Z)-7-[[benzyl(methyl)amino]met…

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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) 6.22 14.09 -46.93 2 4 1 55 428.552 6 ↓
Hi High (pH 8-9.5) 6.22 12.29 -42 0 4 -1 57 426.536 6 ↓
Mid Mid (pH 6-8) 6.22 14.65 -28.68 1 4 0 58 427.544 6 ↓
Mid Mid (pH 6-8) 6.22 11.73 -8.31 1 4 0 54 427.544 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )