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Ligand

NameTripitramine
Molecular formulaC64H77N13O6
IUPAC name11-[2-[6-[8-[6-[bis[2-oxo-2-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)ethyl]amino]hexyl-methylamino]octyl-methylamino]hexylamino]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Molecular weight1124.41
Hydrogen bond acceptor13
Hydrogen bond donor4
XlogP7.7
SynonymsL000604
AC1L31VO
PDSP2_000920
11-[2-[6-[methyl-[8-[methyl-[6-[[2-oxo-2-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)ethyl]amino]hexyl]amino]octyl]amino]hexyl-[2-oxo-2-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)ethyl]amino]acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
DTXSID30165030
[ Show all ]
Inchi KeyYUJOQEAGGUIMED-UHFFFAOYSA-N
Inchi IDInChI=1S/C64H77N13O6/c1-72(41-20-8-5-17-35-65-44-56(78)75-53-32-14-11-26-47(53)62(81)69-50-29-23-36-66-59(50)75)39-18-6-3-4-7-19-40-73(2)42-21-9-10-22-43-74(45-57(79)76-54-33-15-12-27-48(54)63(82)70-51-30-24-37-67-60(51)76)46-58(80)77-55-34-16-13-28-49(55)64(83)71-52-31-25-38-68-61(52)77/h11-16,23-34,36-38,65H,3-10,17-22,35,39-46H2,1-2H3,(H,69,81)(H,70,82)(H,71,83)
PubChem CID132947
ChEMBLCHEMBL265256
IUPHAR361
BindingDB82423
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.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
419535Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460
419536Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
419537Muscarinic acetylcholine receptor M2P08172CHRM2Homo sapiens (Human)466
419538Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
419532Muscarinic acetylcholine receptor M3P20309CHRM3Homo sapiens (Human)590
419534Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
419539Muscarinic acetylcholine receptor M4P08173CHRM4Homo sapiens (Human)479
419540Muscarinic acetylcholine receptor M4P08485Chrm4Rattus norvegicus (Rat)478
419541Muscarinic acetylcholine receptor M4P41986CHRM4Bos taurus (Bovine)126
419533Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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