UCSF

ZINC05260560

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2006 43 No

Popular Name: Neohesperidin dihydrochalcone Neohesperidin dihydrochalcone

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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) -0.01 -8.75 -28.11 9 15 0 245 612.581 10 ↓
Hi High (pH 8-9.5) -0.01 -8.02 -58.89 8 15 -1 248 611.573 10 ↓

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

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