UCSF

ZINC38583236

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 13 No

Popular Name: (3aS)-3,3a,4,7-tetrahydro-[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-dione (3aS)-3,3a,4,7-tetrahydro-[1,2,5…

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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) -1.56 -5.32 -9.77 5 9 0 123 186.131 0 ↓
Mid Mid (pH 6-8) -1.56 -6.15 -34.26 4 9 -1 125 185.123 0 ↓

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

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