UCSF

ZINC66157401

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 24 Yes

Popular Name: 4-[(E)-[(2E)-2-[2-(2-furyl)-2-oxo-ethylidene]-4-oxo-thiazolidin-5-ylidene]methyl]benzoic 4-[(E)-[(2E)-2-[2-(2-furyl)-2-ox…

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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) 2.50 7.76 -57.28 1 6 -1 103 340.336 4 ↓
Ref Reference (pH 7) 2.50 8.04 -60.62 1 6 -1 103 340.336 4 ↓
Mid Mid (pH 6-8) 3.57 6.33 -111.77 0 6 -2 106 339.328 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.