Structure

InChI Key UJYSYPVQHFNBML-UHFFFAOYSA-N
Smiles COC(=O)CCC(=O)CN.Cl
InChI
InChI=1S/C6H11NO3.ClH/c1-10-6(9)3-2-5(8)4-7;/h2-4,7H2,1H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H12ClNO3
Molecular Weight 181.62
AlogP -0.53
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 69.39
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 10.0

Pharmacology

Mechanism of Action Action Reference
DNA inhibitor INHIBITOR DailyMed

Cross References

Resources Reference
ChEBI 60641
ChEMBL CHEMBL1201093
FDA SRS 7S73606O1A
PubChem 157921
SureChEMBL SCHEMBL1177591