UCSF

ZINC41584744

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 36 No

Popular Name: [(2Z)-6-hydroxy-4-methyl-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-7-yl]methylBLAHone [(2Z)-6-hydroxy-4-methyl-3-oxo-2…

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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) 4.58 13.8 -58.5 2 6 1 77 481.572 4 ↓
Hi High (pH 8-9.5) 4.58 12.23 -48.15 0 6 -1 79 479.556 4 ↓
Mid Mid (pH 6-8) 4.58 11.65 -22.64 1 6 0 76 480.564 4 ↓
Mid Mid (pH 6-8) 4.58 14.38 -34.18 1 6 0 80 480.564 4 ↓

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

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