UCSF

ZINC62955045

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 20th, 2011 21 No

Popular Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-(3,4-dihydroxyphenyl)ethanone 2-(8-azaspiro[4.5]decan-8-yl)-1-…

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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) 2.41 5.59 -47.67 3 4 1 62 290.383 3 ↓
Hi High (pH 8-9.5) 2.41 4.32 -44.29 1 4 -1 64 288.367 3 ↓
Mid Mid (pH 6-8) 2.41 3.39 -10.92 2 4 0 61 289.375 3 ↓

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

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