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

General Information of Drug (ID: DR5927)
Drug Name	Avacopan
Synonyms	Avacopan\|1346623-17-3\|CCX168\|Avacopan [INN]\|Avacopan [USAN]\|Tavneos\|CCX-168\|O880NM097T\|Avacopan [USAN:INN]\|UNII-O880NM097T\|(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide\|(2R,3S)-2-(4-(cyclopentylamino)phenyl)-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-(trifluoromethyl)phenyl)piperidine-3-carboxamide\|3-Piperidinecarboxamide, 2-(4-(cyclopentylamino)phenyl)-1-(2-fluoro-6-methylbenzoyl)-N-(4-methyl-3-(trifluoromethyl)phenyl)-, (2R,3S)-\|CCX168; Avacopan\|AVACOPAN [JAN]\|AVACOPAN [WHO-DD]\|Avacopan (JAN/USAN/INN)\|AVACOPAN [ORANGE BOOK]\|GTPL9450\|SCHEMBL2567144\|CHEMBL3989871\|C33H35F4N3O2\|DTXSID701102660\|EX-A2605\|MFCD28502293\|AKOS040759342\|AT30195\|CS-6888\|DB15011\|AC-35654\|HY-17627\|J3.663.585A\|D11093\|Q27285470\|(2R,3S)-2-[4-(cyclopentylamino)phenyl]-1-(2-fluoro-6-methyl-benzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]piperidine-3-carboxamide\|(2R,3S)-2-[4-(Cyclopentylamino)phenyl]-1-(2-fluoro-6-methylbenzoyl)-N-[4-methyl-3-(trifluoromethyl)phenyl]-3-piperidinecarboxamide\|EFD
Pharmaceutical Properties	Molecular Weight	581.6	Topological Polar Surface Area	61.4
	Heavy Atom Count	42	Rotatable Bond Count	6
	Hydrogen Bond Donor Count	2	Hydrogen Bond Acceptor Count	7
Cross-matching ID	PubChem CID 49841217 Formula C33H35F4N3O2 Canonical SMILES CC1=C(C(=CC=C1)F)C(=O)N2CCCC(C2C3=CC=C(C=C3)NC4CCCC4)C(=O)NC5=CC(=C(C=C5)C)C(F)(F)F InChI InChI=1S/C33H35F4N3O2/c1-20-12-15-25(19-27(20)33(35,36)37)39-31(41)26-10-6-18-40(32(42)29-21(2)7-5-11-28(29)34)30(26)22-13-16-24(17-14-22)38-23-8-3-4-9-23/h5,7,11-17,19,23,26,30,38H,3-4,6,8-10,18H2,1-2H3,(H,39,41)/t26-,30-/m0/s1 InChIKey PUKBOVABABRILL-YZNIXAGQSA-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
Avacopan M1	DM005003	N. A.	Oxidation - Mono-hydroxylation	1	[2]

The Full List of Metabolic Reaction (MR) of This Drug

MR ID	Reactant	Product	MR Type	DME	REF
MR005427	Avacopan	Avacopan M1	Oxidation - Mono-hydroxylation	Unclear	[2]

Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug

DME Name	DME Info	Species	Uniprot ID	EC Number	REF
Cytochrome P450 3A4 (CYP3A4)	DME0001	Homo sapiens	CP3A4_HUMAN	1.14.14.55	[1]

References
1	LABEL:Avacopan
2	LABEL:TAVNEOS- avacopan capsule

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