UCSF

ZINC34944350

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 34 No

Popular Name: (4E,5S)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-5-(4-hydroxy-3-methoxy-phenyl)-1-(2-morpholinoeth (4E,5S)-4-[(2,5-dimethylphenyl)-…

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Download: MOL2 SDF SMILES Flexibase

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) 2.42 5.56 -45.38 1 8 -1 102 465.526 7 ↓
Mid Mid (pH 6-8) 2.42 7.83 -56.06 2 8 0 104 466.534 7 ↓
Lo Low (pH 4.5-6) 2.42 7.08 -49.62 3 8 1 101 467.542 7 ↓

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