MEVIDALEN

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Synonyms
Status
Molecule Category Free-form
UNII 4A3702A96F

Structure

InChI Key XHCSBQBBGNQINS-DOTOQJQBSA-N
Smiles C[C@H]1c2cccc(CCC(C)(C)O)c2C[C@H](CO)N1C(=O)Cc1c(Cl)cccc1Cl
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

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H29Cl2NO3
Molecular Weight 450.41
AlogP 4.75
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 6.0
Polar Surface Area 60.77
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 30.0

Pharmacology

Mechanism of Action Action Reference
Dopamine D1 receptor positive allosteric modulator POSITIVE ALLOSTERIC MODULATOR PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Dopamine receptor
1.11-62.1 - - - -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Canis lupus familiaris
2 - - - -
Homo sapiens
1.11-12.8 - - - -
Macaca mulatta
2.5 - - - -
Mus musculus
62.1 - - - -

Target Conservation

Protein: Dopamine D1 receptor
Description: D(1A) dopamine receptor
Organism : Homo sapiens
P21728 ENSG00000184845

Cross References

Resources Reference
ChEMBL CHEMBL3421729
FDA SRS 4A3702A96F
Guide to Pharmacology 10506
PDB G4C
PubChem 86290953
SureChEMBL SCHEMBL16267372
ZINC ZINC000220050656
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