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

General Information of Drug (ID: DR1297)
Drug Name
Piperazine
Synonyms
Piperazidine; Piperazin; Piperazin [German]; Piperazin [Germany]; Piperazine (USP); Piperazine anhydrous; Piperazine, anhydrous; Pipersol; Pyrazine hexahydride; Pyrazine, hexahydro-; Upixon; Uvilon; Vermex; Vermizine (TN); Worm-A-Ton; Anthalazine; Antiren; Asca-Trol No. 3; Diethylenediamine; Diethyleneimine; Dispermine; Eraverm; Eraverm (VAN); Hexahydro-1,4-diazine; Hexahydropyrazine; Lumbrical; Wurmirazin; piperazine; 1,4-Diazacyclohexane; 1,4-Diethylenediamine; 1,4-Piperazine; 110-85-0; MFCD00005953; NSC 474; UNII-1RTM4PAL0V
Indication Ascariasis [ICD11: 1F62] Approved [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 86.14 Topological Polar Surface Area 24.1
Heavy Atom Count 6 Rotatable Bond Count 0
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 2
Cross-matching ID
PubChem CID
4837
PubChem SID
10174 ; 67380 ; 587321 ; 3134286 ; 5514467 ; 7847872 ; 8144317 ; 8149486 ; 8152972 ; 10503893 ; 11335213 ; 11360452 ; 11364007 ; 11366569 ; 11369131 ; 11377293 ; 11448501 ; 11448505 ; 11448541 ; 11448548 ; 11448550 ; 11448588 ; 11448590 ; 11448628 ; 11448668 ; 11448748 ; 11448779 ; 11448786 ; 11452303 ; 11452307 ; 11452335 ; 11452347 ; 11452377 ; 11452383 ; 11452387 ; 11452415 ; 11452425 ; 11452427 ; 11452455 ; 11452465 ; 11452467 ; 11452495 ; 11452505 ; 11452507 ; 11452535 ; 11452545 ; 11452575 ; 11452581 ; 11452617 ; 11452653
ChEBI ID
ChEBI:28568
CAS Number
110-85-0
TTD Drug ID
D01XLM
Formula
C4H10N2
Canonical SMILES
C1CNCCN1
InChI
1S/C4H10N2/c1-2-6-4-3-5-1/h5-6H,1-4H2
InChIKey
GLUUGHFHXGJENI-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
N-mononitrosopiperazine DM002864
21845
Unclear 1 [2] , [3]
N-nitroso-3-hydroxypyrrolidine DM002865
3034827
Oxidation - Hydroxylation 2 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR002059 Piperazine N-mononitrosopiperazine Unclear CYP2D6 [2], [3]
MR002058 N-mononitrosopiperazine N-nitroso-3-hydroxypyrrolidine Oxidation - Hydroxylation Unclear [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Cytochrome P450 2D6 (CYP2D6) DME0009 Homo sapiens
CP2D6_HUMAN
1.14.14.1
[2]
References
1 Piperazine was approved by FDA. The 2020 official website of the U.S. Food and Drug Administration.
2 Chemistry, pharmacology, toxicology, and hepatic metabolism of designer drugs of the amphetamine (ecstasy), piperazine, and pyrrolidinophenone types: a synopsis. Ther Drug Monit. 2004 Apr;26(2):127-31.
3 Hazardous Substances Data Bank:Piperazine

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