UCSF

ZINC62955024

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 19 Yes

Popular Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-(5-chloro-2-thienyl)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) 4.08 10.23 -38.96 1 2 1 22 298.859 3 ↓
Mid Mid (pH 6-8) 4.08 8.04 -4.55 0 2 0 20 297.851 3 ↓

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

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