UCSF

ZINC66447064

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 28 Yes

Popular Name: (2E)-2-cyano-2-[(5Z)-5-[(2,3-dimethylphenyl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]-N-(3-et (2E)-2-cyano-2-[(5Z)-5-[(2,3-dim…

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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) 2.65 8.57 -10.81 1 6 0 84 399.516 7 ↓
Hi High (pH 8-9.5) 2.84 6.99 -45.03 0 6 -1 90 398.508 7 ↓

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

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