UCSF

ZINC41206194

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 17th, 2010 14 No

Popular Name: 1-[2-(2-furyl)ethyl]piperidin-4-one 1-[2-(2-furyl)ethyl]piperidin-4-one

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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) 0.98 6.35 -47.35 1 3 1 35 194.254 3 ↓
Hi High (pH 8-9.5) 0.98 4.14 -6.8 0 3 0 33 193.246 3 ↓

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Rings

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

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