plazinemdor   Click here for help

GtoPdb Ligand ID: 12051

Synonyms: CAD-9303 | CAD9303 | Compound 1 [WO2020086136A2]
Compound class: Synthetic organic
Comment: Plazinemdor (CAD-9303) is a positive allosteric modulator (PAM) of N-Methyl-D-aspartate (NMDA) ligand-gated ion channel receptors that was designed as a potential treatment for the negative and cognitive symptoms that are experienced by patients with schizophrenia. Its chemical structure and use are claimed in Cadent Therapeutics' patent WO2020086136A2 [1].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 60.13
Molecular weight 432.12
XLogP 4.58
No. Lipinski's rules broken 0
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Canonical SMILES O=C(N1CC(C1)(C)F)Cn1cnc2c(c1=O)c(cn2C1CC1)c1ccc(c(c1)Cl)F
Isomeric SMILES CC1(CN(C1)C(=O)Cn1cnc2c(c1=O)c(cn2C1CC1)c1cc(c(cc1)F)Cl)F
InChI InChI=1S/C21H19ClF2N4O2/c1-21(24)9-27(10-21)17(29)8-26-11-25-19-18(20(26)30)14(7-28(19)13-3-4-13)12-2-5-16(23)15(22)6-12/h2,5-7,11,13H,3-4,8-10H2,1H3
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
11579 plazinemdor
Synonyms Click here for help
CAD-9303 | CAD9303 | Compound 1 [WO2020086136A2]
Database Links Click here for help
CAS Registry No. 2378285-59-5 (source: WHO INN record)
GtoPdb PubChem SID 472319174
PubChem CID 146315728
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UniChem Compound Search for chemical match using the InChIKey NULHGWQIRTXKAY-UHFFFAOYSA-N
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