UCSF

ZINC41599021

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 20 No

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

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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) -0.67 2.44 -54.52 3 7 1 92 279.32 2 ↓
Hi High (pH 8-9.5) -1.05 0.19 -47.69 2 7 0 98 278.312 2 ↓

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

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