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Ligand

NameCHEMBL285012
Molecular formulaC27H32N4O5S
IUPAC nameN-methyl-N-[3-[5-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]indol-1-yl]propyl]methanesulfonamide
Molecular weight524.636
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP2.6
SynonymsBDBM50219759
Inchi KeyCFEMQYFHLLIQOO-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H32N4O5S/c1-28(37(2,34)35)13-5-14-29-15-10-20-18-21(8-9-24(20)29)26(32)30-16-11-23(12-17-30)31-25-7-4-3-6-22(25)19-36-27(31)33/h3-4,6-10,15,18,23H,5,11-14,16-17,19H2,1-2H3
PubChem CID44279433
ChEMBLCHEMBL285012
IUPHARN/A
BindingDB50219759
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
40573Oxytocin receptorP30559OXTRHomo sapiens (Human)389

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