UCSF

ZINC12413425

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2008 29 No

Popular Name: ethyl 4-[4-(methoxycarbonyl)benzylidene]-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate ethyl 4-[4-(methoxycarbonyl)benz…

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Other Names:

MFCD00684427

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) 3.69 13.05 -12.75 0 6 0 75 391.423 7 ↓
Ref Reference (pH 7) 3.69 12.77 -12.62 0 6 0 75 391.423 7 ↓

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