Structure

InChI Key BMKDZUISNHGIBY-UHFFFAOYSA-N
Smile CC(CN1CC(=O)NC(=O)C1)N1CC(=O)NC(=O)C1
InChI
InChI=1S/C11H16N4O4/c1-7(15-5-10(18)13-11(19)6-15)2-14-3-8(16)12-9(17)4-14/h7H,2-6H2,1H3,(H,12,16,17)(H,13,18,19)

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H16N4O4
Molecular Weight 268.27
AlogP -2.71
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 98.82
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 19.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 50225
ChEMBL CHEMBL444186
DrugCentral 4031
EPA CompTox DTXSID0020733
FDA SRS 5AR83PR647
PubChem 30623
SureChEMBL SCHEMBL9089