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Ligand

Namecid_657898
Molecular formulaC16H16N4O2S
IUPAC name4-(4-ethoxy-3-methoxyphenyl)-2,6-diiminothiane-3,5-dicarbonitrile
Molecular weight328.39
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.3
Synonyms2,6-diamino-4-(4-ethoxy-3-methoxy-phenyl)-4H-thiopyran-3,5-dicarbonitrile
2,6-bis(azanyl)-4-(4-ethoxy-3-methoxy-phenyl)-4H-thiopyran-3,5-dicarbonitrile
BDBM48919
Inchi KeyCNFQHWNHJOBHKT-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H16N4O2S/c1-3-22-12-5-4-9(6-13(12)21-2)14-10(7-17)15(19)23-16(20)11(14)8-18/h4-6,10-11,14,19-20H,3H2,1-2H3
PubChem CID91896778
ChEMBLN/A
IUPHARN/A
BindingDB48919
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
45995D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
45996D(1B) dopamine receptorP21918DRD5Homo sapiens (Human)477

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