UCSF

ZINC44018434

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2010 17 No

Popular Name: (2E)-2-[(E)-3-(2-furyl)-1-hydroxy-prop-2-enylidene]-4-methyl-cyclopent-4-ene-1,3-dione (2E)-2-[(E)-3-(2-furyl)-1-hydrox…

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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) 1.97 5.79 -49.08 0 4 -1 70 229.211 3 ↓
Lo Low (pH 4.5-6) 0.55 5.97 -10.79 0 4 0 64 230.219 3 ↓

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

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