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Ligand

NameAC1M7NVA
Molecular formulaC16H16N4O3
IUPAC name5-[(5-acetyl-2-methoxyphenyl)methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one
Molecular weight312.329
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP0.7
Synonyms5-[(5-acetyl-2-methoxyphenyl)methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one
MLS000770123
Z55416507
AKOS034445191
HMS2748I19
[ Show all ]
Inchi KeyBFAXUWDHEVBAFC-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H16N4O3/c1-10(21)11-4-5-14(23-3)12(6-11)8-20-9-17-15-13(16(20)22)7-18-19(15)2/h4-7,9H,8H2,1-3H3
PubChem CID2445448
ChEMBLCHEMBL1386075
IUPHARN/A
BindingDBN/A
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: 3
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GLASS IDNameUniProtGeneSpeciesLength
22127Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
22129Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
22128Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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