Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR0728)
Drug Name
Flurazepam
Synonyms
Felison; Felmane; Flurazepam HCL; Flurazepam [INN:BAN:JAN]; Flurazepamum; Flurazepamum [INN-Latin]; IHP475989U; Insumin; Noctosom; Dalmadorm; Dalmane; Dalmane-R; Ro-5-6901/3; SAADBVWGJQAEFS-UHFFFAOYSA-N; Stauroderm; flurazepam; 17617-23-1; 7-Chloro-1-(2-(diethylamino)ethyl)-5-(2-fluorophenyl)-1H-1,4-benzodiazepin-2(3H)-one; 7-Chloro-1-[2-(diethylamino)ethyl]-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one; BRN 0767925; DEA No. 2767; EINECS 241-591-7; HSDB 3085; UNII-IHP475989U
Indication Insomnia [ICD11: 7A00] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 387.9 Topological Polar Surface Area 35.9
Heavy Atom Count 27 Rotatable Bond Count 6
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4
Cross-matching ID
PubChem CID
3393
PubChem SID
5373981 ; 7847395 ; 7979292 ; 8152162 ; 10510931 ; 16847426 ; 26757995 ; 29222528 ; 46508451 ; 48416030 ; 49884134 ; 57321773 ; 74737372 ; 81065483 ; 103252248 ; 104303383 ; 125343184 ; 126666911 ; 127346536 ; 127346537 ; 129206359 ; 131302560 ; 134337556 ; 134961907 ; 134991466 ; 137005121 ; 139650929 ; 144205754 ; 152029390 ; 152146193 ; 160964035 ; 164814237 ; 170465018 ; 175265966 ; 177513104 ; 178103763 ; 179116700 ; 198993237 ; 221672978 ; 223661920 ; 226416782 ; 249949893 ; 252349925
ChEBI ID
CHEBI:5128
CAS Number
17617-23-1
TTD Drug ID
D08XFV
Formula
C21H23ClFN3O
Canonical SMILES
CCN(CC)CCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F
InChI
1S/C21H23ClFN3O/c1-3-25(4-2)11-12-26-19-10-9-15(22)13-17(19)21(24-14-20(26)27)16-7-5-6-8-18(16)23/h5-10,13H,3-4,11-12,14H2,1-2H3
InChIKey
SAADBVWGJQAEFS-UHFFFAOYSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
Flurazepam Metabolite DM004682
6427074
Unclear 1 [3]
Hydroxyethylflurazepam DM004687
128762
Unclear 1 [3]
N-desalkyl flurazepam DM003029
4540
Unclear 1 [3]
Flurazepam Metabolite DM004686
28648
Unclear 2 [3]
Flurazepam Metabolite-DE DM004683
28647
Unclear 2 [3]
N-desalkyl flurazepam DM003029
4540
Unclear 2 [3]
Flurazepam Metabolite DM004686
28648
Unclear 3 [3]
Flurazepam Metabolite DM004684
30401
Unclear 3 [3]
N-desalkyl flurazepam DM003029
4540
Unclear 3 [3]
Flurazepam Metabolite DM004686
28648
Unclear 4 [3]
N-desalkyl flurazepam DM003029
4540
Unclear 4 [3]
Flurazepam Metabolite DM004686
28648
Unclear 5 [3]
⏷ Show the Full List of 12  DM(s)
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR005032 Flurazepam Flurazepam Metabolite Unclear Unclear [3]
MR005039 Flurazepam N-desalkyl flurazepam Unclear Unclear [3]
MR005040 Flurazepam Hydroxyethylflurazepam Unclear Unclear [3]
MR005033 Flurazepam Metabolite Flurazepam Metabolite-DE Unclear Unclear [3]
MR005038 Flurazepam Metabolite N-desalkyl flurazepam Unclear Unclear [3]
MR005034 Flurazepam Metabolite-DE Flurazepam Metabolite Unclear Unclear [3]
MR005037 Flurazepam Metabolite-DE N-desalkyl flurazepam Unclear Unclear [3]
MR005035 Flurazepam Metabolite N-desalkyl flurazepam Unclear Unclear [3]
MR005036 N-desalkyl flurazepam Flurazepam Metabolite Unclear Unclear [3]
⏷ Show the Full List of 9 MR(s)
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 2A6 (CYP2A6) DME0005 Homo sapiens
CP2A6_HUMAN
1.14.14.1
[2]
Cytochrome P450 3A4 (CYP3A4) DME0001 Homo sapiens
CP3A4_HUMAN
1.14.14.55
[2]
References
1 Flurazepam was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Is 1-aminobenzotriazole an appropriate in vitro tool as a nonspecific cytochrome P450 inactivator? Drug Metab Dispos. 2009 Jan;37(1):10-3.
3 Metabolism of flurazepam, a benzodiazepine, in man and dog

If you find any error in data or bug in web service, please kindly report it to Dr. Yin and Dr. Li.