UCSF

ZINC14010508

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2008 24 No

Popular Name: ethyl 4-(2-hydroxybenzylidene)-1-(2-methoxyethyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate ethyl 4-(2-hydroxybenzylidene)-1…

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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) 2.17 6.26 -12.16 1 6 0 78 331.368 7 ↓
Ref Reference (pH 7) 2.17 5.95 -16.18 1 6 0 78 331.368 7 ↓
Hi High (pH 8-9.5) 2.17 6.81 -58.18 0 6 -1 81 330.36 7 ↓
Hi High (pH 8-9.5) 2.17 7.03 -54.42 0 6 -1 81 330.36 7 ↓

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

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