Synonyms
Status
Molecule Category Free-form
UNII RFR2CH3QZK
EPA CompTox DTXSID30905079

Structure

InChI Key ANWPENAPCIFDSZ-RQJHMYQMSA-N
Smiles CC[C@@H](C(N)=O)N1C[C@H](C=C(F)F)CC1=O
InChI
InChI=1S/C10H14F2N2O2/c1-2-7(10(13)16)14-5-6(3-8(11)12)4-9(14)15/h3,6-7H,2,4-5H2,1H3,(H2,13,16)/t6-,7+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H14F2N2O2
Molecular Weight 232.23
AlogP 0.88
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 63.4
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 16.0

Related Entries

Cross References

Resources Reference
CAS NUMBER 357336-74-4
ChEMBL CHEMBL3918017
DrugBank DB05885
FDA SRS RFR2CH3QZK
PubChem 9942725
SureChEMBL SCHEMBL387920
ZINC ZINC000011726774