UCSF

ZINC17138996

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2008 32 No

Popular Name: (4E,5S)-5-(3,4-dimethoxyphenyl)-4-[hydroxy-(4-methoxy-3-methyl-phenyl)methylene]-1-(2-methoxyethyl)p (4E,5S)-5-(3,4-dimethoxyphenyl)-…

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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) 2.44 6.8 -64.03 0 8 -1 97 440.472 9 ↓
Mid Mid (pH 6-8) 1.86 6.94 -16.02 0 8 0 91 441.48 9 ↓
Lo Low (pH 4.5-6) 2.44 5.98 -19.42 1 8 0 95 441.48 9 ↓

Activity (Go SEA)

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