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

General Information of Drug (ID: DR2923)
Drug Name
Odapipam
Synonyms NNC 0756; NNC-756; NNC-01-0756
Indication Psychotic disorder [ICD11: 6A20-6A25] Discontinued in Phase 1 [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 329.8 Topological Polar Surface Area 32.7
Heavy Atom Count 23 Rotatable Bond Count 1
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3
Cross-matching ID
PubChem CID
132421
CAS Number
131796-63-9
TTD Drug ID
D03DXS
Formula
C19H20ClNO2
Canonical SMILES
CN1CCC2=CC(=C(C=C2[C@H](C1)C3=CC=CC4=C3OCC4)O)Cl
InChI
InChI=1S/C19H20ClNO2/c1-21-7-5-13-9-17(20)18(22)10-15(13)16(11-21)14-4-2-3-12-6-8-23-19(12)14/h2-4,9-10,16,22H,5-8,11H2,1H3/t16-/m1/s1
InChIKey
SKMVRXPBCSTNKE-MRXNPFEDSA-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
Odapipam M1 DM015166
130424
Unclear 1 [3]
Odapipam M2 DM019559 N. A. Unclear 1 [3]
Odapipam M3 DM019560 N. A. Unclear 1 [3]
Odapipam M4 DM019561 N. A. Unclear 1 [3]
Odapipam M5 DM019562 N. A. Unclear 1 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR013631 Odapipam Odapipam M1 Unclear UGT [3]
MR013632 Odapipam Odapipam M2 Unclear UGT [3]
MR013633 Odapipam Odapipam M3 Unclear UGT [3]
MR013634 Odapipam Odapipam M4 Unclear UGT [3]
MR013635 Odapipam Odapipam M5 Unclear UGT [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
UDP-glucuronyltransferase (UGT) DMEN064 . Not Available Not Available [2]
References
1 Trusted, scientifically sound profiles of drug programs, clinical trials, safety reports, and company deals, written by scientists. Springer. 2015. Adis Insight (drug id 800006052)
2 Characterization of benzazepine UDP-glucuronosyl-transferases in laboratory animals and man
3 Normal-phase liquid chromatography-particle-beam mass spectrometry in drug metabolism studies of the dopamine receptor antagonist Odapipam and the muscarine M1 receptor agonist Xanomeline

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