NIFURVIDINE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII Y0G95D5K2W

Structure

InChI Key ACKMNMNAWGSMBP-UHFFFAOYSA-N
Smiles CC1=NC(=O)C=C(N1)/C=C/c2oc(cc2)[N+]([O-])=O
InChI
InChI=1S/C11H9N3O4/c1-7-12-8(6-10(15)13-7)2-3-9-4-5-11(18-9)14(16)17/h2-5H,6H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H9N3O4
Molecular Weight 247.06
AlogP 1.99
Hydrogen Bond Acceptor 5.0
Number of Rotational Bond 3.0
Polar Surface Area 98.07
Heavy Atoms 18.0

Cross References

Resources Reference
CAS NUMBER 1900-13-6
NORMAN SUSDAT
FDA SRS Y0G95D5K2W
CONTENTS