UCSF

ZINC04889442

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2006 28 No

Popular Name: 2-[2-furyl-(1-hydroxy-3-oxo-inden-2-yl)-methyl]indane-1,3-dione 2-[2-furyl-(1-hydroxy-3-oxo-inde…

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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) 3.98 10.56 -134.06 0 5 -2 93 368.344 3 ↓
Mid Mid (pH 6-8) 3.43 10.51 -52.82 0 5 -1 87 369.352 3 ↓
Lo Low (pH 4.5-6) 2.87 10.46 -13.16 0 5 0 81 370.36 3 ↓

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

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