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Ligand

NameCHEMBL367958
Molecular formulaC27H36N6O8S2
IUPAC nameN-[6-[2-(ethylsulfonylamino)ethoxy]-5-(2-methoxyphenoxy)-2-morpholin-4-ylpyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide
Molecular weight636.739
Hydrogen bond acceptor14
Hydrogen bond donor2
XlogP2.8
SynonymsN-[2-[2-Morpholino-5-(2-methoxyphenoxy)6-(5-isopropyl-2-pyridinylsulfonylamino)-4-pyrimidinyloxy]ethyl]ethanesulfonamide
5-Isopropyl-pyridine-2-sulfonic acid [6-(2-ethanesulfonylamino-ethoxy)-5-(2-methoxy-phenoxy)-2-morpholin-4-yl-pyrimidin-4-yl]-amide
SCHEMBL7197689
BDBM50124431
Inchi KeyDNIIBGYNGASUDE-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H36N6O8S2/c1-5-42(34,35)29-12-15-40-26-24(41-22-9-7-6-8-21(22)38-4)25(30-27(31-26)33-13-16-39-17-14-33)32-43(36,37)23-11-10-20(18-28-23)19(2)3/h6-11,18-19,29H,5,12-17H2,1-4H3,(H,30,31,32)
PubChem CID9830773
ChEMBLCHEMBL367958
IUPHARN/A
BindingDB50124431
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
64389Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
64391Endothelin receptor type BP24530EDNRBHomo sapiens (Human)442
64388Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427
64390Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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