UCSF

ZINC61409543

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 21 No

Popular Name: 2-[(2,5-dimethylphenyl)methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione 2-[(2,5-dimethylphenyl)methyl]-2…

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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) 1.29 5.31 -52.38 3 5 1 66 288.371 2 ↓
Hi High (pH 8-9.5) 1.29 3.98 -6.47 2 5 0 61 287.363 2 ↓

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

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