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Ligand

NameCHEMBL151356
Molecular formulaC33H42Cl2N4O2
IUPAC nameN-[1-[1-[2-[1-(cyclopropylmethyl)-3-(3,4-dichlorophenyl)-6-oxopiperidin-3-yl]ethyl]azetidin-3-yl]-4-phenylpiperidin-4-yl]acetamide
Molecular weight597.625
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.0
SynonymsBDBM50409638
Inchi KeyASSBEMCEDOONKS-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H42Cl2N4O2/c1-24(40)36-33(26-5-3-2-4-6-26)14-17-38(18-15-33)28-21-37(22-28)16-13-32(27-9-10-29(34)30(35)19-27)12-11-31(41)39(23-32)20-25-7-8-25/h2-6,9-10,19,25,28H,7-8,11-18,20-23H2,1H3,(H,36,40)
PubChem CID44366988
ChEMBLCHEMBL151356
IUPHARN/A
BindingDB50409638
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
13477Substance-P receptorP25103TACR1Homo sapiens (Human)407

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