mevidalen   Click here for help

GtoPdb Ligand ID: 10506

Synonyms: compound 3 [PMID: 31532644] | LY-3154207 | LY3154207
PDB Ligand
Compound class: Synthetic organic
Comment: Mevidalen (LY3154207) is a potent, selective and orally active dopamine D1 receptor positive allosteric modulator (PAM) [1]. The allosteric binding site of LY3154207 has been determined to reside at the intracellular loop 2 (ICL2) region of the receptor.
D1 PAMs are being developed to address the poor drug-like properties of selective orthosteric D1 agonists. In particular, LY3154207 does not induce tachyphylaxis in preclinical models, whereas orthosteric agonists do. LY3154207 exhibits pro-cognitive and motor-enhancing effects in vivo, and is being considered for potential utility in the treatment of neuropsychiatric disorders [2].
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 60.77
Molecular weight 449.15
XLogP 4.62
No. Lipinski's rules broken 0
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Canonical SMILES OCC1Cc2c(cccc2C(N1C(=O)Cc1c(Cl)cccc1Cl)C)CCC(O)(C)C
Isomeric SMILES OC[C@H]1Cc2c(cccc2[C@@H](N1C(=O)Cc1c(Cl)cccc1Cl)C)CCC(O)(C)C
InChI InChI=1S/C24H29Cl2NO3/c1-15-18-7-4-6-16(10-11-24(2,3)30)19(18)12-17(14-28)27(15)23(29)13-20-21(25)8-5-9-22(20)26/h4-9,15,17,28,30H,10-14H2,1-3H3/t15-,17+/m0/s1
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
11352 mevidalen
Synonyms Click here for help
compound 3 [PMID: 31532644] | LY-3154207 | LY3154207
Database Links Click here for help
Specialist databases
GPCRdb Ligand mevidalen
Other databases
ChEMBL Ligand CHEMBL3421729
GtoPdb PubChem SID 387065588
PubChem CID 86290953
Search Google for chemical match using the InChIKey XHCSBQBBGNQINS-DOTOQJQBSA-N
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UniChem Compound Search for chemical match using the InChIKey XHCSBQBBGNQINS-DOTOQJQBSA-N
UniChem Connectivity Search for chemical match using the InChIKey XHCSBQBBGNQINS-DOTOQJQBSA-N