UCSF

ZINC62955017

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 18 Yes

Popular Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-(1H-pyrrol-2-yl)ethanone 2-(8-azaspiro[4.5]decan-8-yl)-1-…

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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) 2.53 8.34 -40.62 2 3 1 37 247.362 3 ↓
Mid Mid (pH 6-8) 2.53 6.15 -8.79 1 3 0 36 246.354 3 ↓

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

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