UCSF

ZINC37839429

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 18 No

Popular Name: 8-(3-oxobutanoyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-(3-oxobutanoyl)-1,3,8-triazasp…

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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) -1.44 1.31 -22.61 2 7 0 96 253.258 2 ↓
Hi High (pH 8-9.5) -1.26 -1.33 -53.85 1 7 -1 102 252.25 2 ↓
Hi High (pH 8-9.5) -0.70 0.17 -52.5 2 7 -1 102 252.25 1 ↓

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