UCSF

ZINC67934071

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 28 Yes

Popular Name: 8-[[(3S)-3-hydroxy-2-oxo-1-phenethyl-3-piperidyl]methyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one 8-[[(3S)-3-hydroxy-2-oxo-1-phene…

Find On: PubMed — Wikipedia — Google

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) 1.28 5.73 -39.05 3 7 1 83 388.488 5 ↓
Hi High (pH 8-9.5) 1.28 4.71 -14.97 2 7 0 82 387.48 5 ↓

Activity (Go SEA)

Rings

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

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