Details of the Drug

General Information of Drug (ID: DMJYNMC)

Drug Name
FAMOXADONE
Synonyms
(S)-famoxadone; (-)-famoxadone; (S)-(-)-famoxadone; CHEBI:106738; (5S)-5-methyl-5-(4-phenoxyphenyl)-3-(phenylamino)-1,3-oxazolidine-2,4-dione; (5S)-3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione; (S)-5-Methyl-5-(4-phenoxy-phenyl)-3-phenylamino-oxazolidine-2,4-dione; 5-METHYL-5-(4-PHENOXYPHENYL)-3-(PHENYLAMINO)-2,4-OXAZOLIDINEDIONE; FMX; AC1L9K5S; CHEMBL10118; SCHEMBL673443; PCCSBWNGDMYFCW-QFIPXVFZSA-N; ZINC6491064; DB07778; AJ-56253; UNII-V1C07OR6II component PCCSBWNGDMYFCW-QFIPXVFZSA-N
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 374.4
Logarithm of the Partition Coefficient (xlogp) 5
Rotatable Bond Count (rotbonds) 5
Hydrogen Bond Donor Count (hbonddonor) 1
Hydrogen Bond Acceptor Count (hbondacc) 5
Chemical Identifiers
Formula
C22H18N2O4
IUPAC Name
3-anilino-5-methyl-5-(4-phenoxyphenyl)-1,3-oxazolidine-2,4-dione
Canonical SMILES
CC1(C(=O)N(C(=O)O1)NC2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=CC=C4
InChI
InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3
InChIKey
PCCSBWNGDMYFCW-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
213032
ChEBI ID
CHEBI:83250
CAS Number
131807-57-3
DrugBank ID
DB07778
TTD ID
D0O1FU

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Plasmodium Cytochrome B (Malaria MT-CYB) TTRAMF0 CYB_PLAFA Inhibitor [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42.