CARPHENAZINE MALEATE

/static/temp/default.svg

Search structure


Trade Names	PROKETAZINE
Synonyms	Carfenazine maleate Carphenazine Carphenazine dimaleate Carphenazine maleate NSC-71755 Proketazine WY-2445
Status
Molecule Category	Mixture
UNII	0HX1Z0A2MC
EPA CompTox	DTXSID2047852


Active Pharmaceutical Ingredients Bioactive chemicals	Exact Similarity SubStructure	Threshold (%) >= 70

Structure


InChI Key	TVPJGGZLZLUPOB-SPIKMXEPSA-N
Smiles	CCC(=O)c1ccc2c(c1)N(CCCN1CCN(CCO)CC1)c1ccccc1S2.O=C(O)/C=C\C(=O)O.O=C(O)/C=C\C(=O)O
InChI	InChI=1S/C24H31N3O2S.2C4H4O4/c1-2-22(29)19-8-9-24-21(18-19)27(20-6-3-4-7-23(20)30-24)11-5-10-25-12-14-26(15-13-25)16-17-28;25-3(6)1-2-4(7)8/h3-4,6-9,18,28H,2,5,10-17H2,1H3;21-2H,(H,5,6)(H,7,8)/b;2*2-1-

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C32H39N3O10S
Molecular Weight	657.74
AlogP	3.88
Hydrogen Bond Acceptor	6.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	8.0
Polar Surface Area	47.02
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	30.0

Bioactivity

Mechanism of Action	Action	Reference
Dopamine D2 receptor antagonist	ANTAGONIST	ISBN PubMed Wikipedia


Protein: Dopamine D2 receptor Description: D(2) dopamine receptor Organism : Homo sapiens P14416 ENSG00000149295











Protein: Serotonin 2a (5-HT2a) receptor Description: 5-hydroxytryptamine receptor 2A Organism : Homo sapiens P28223 ENSG00000102468












Protein: Serotonin 2c (5-HT2c) receptor Description: 5-hydroxytryptamine receptor 2C Organism : Homo sapiens P28335 ENSG00000147246

Cross References

Resources	Reference
ChEBI	51241
ChEMBL	CHEMBL2358147
FDA SRS	0HX1Z0A2MC
PubChem	6433356
SureChEMBL	SCHEMBL120590

CONTENTS

PREMIER has received funding from the Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information this manuscript contains.

Elements of the website have been developed under projects PREMIER and the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT is thanked for providing computational resources. Content of the website is provided without guarantee for correctness. Data has been collected and integrated from multiple public sources, for the largest: FDA, HUGO Gene Nomenclature Committee, ChEMBL, IUPHAR/BPS guide to pharmacology, Reactome, UniProt, and Ensembl. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).