UCSF

ZINC41584690

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 32 Yes

Popular Name: 7-hydroxy-2-methyl-3-phenyl-8-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]chromen-4-one 7-hydroxy-2-methyl-3-phenyl-8-[[…

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Download: MOL2 SDF SMILES Flexibase

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Vendors

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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) 4.71 12.13 -44.85 2 5 1 68 427.524 4 ↓
Hi High (pH 8-9.5) 4.71 12.7 -29.17 1 5 0 71 426.516 4 ↓
Hi High (pH 8-9.5) 4.71 10.31 -10.77 1 5 0 67 426.516 4 ↓

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

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