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Ligand

NameBzATP
Molecular formulaC24H24N5O15P3
IUPAC name[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 4-benzoylbenzoate
Molecular weight715.397
Hydrogen bond acceptor19
Hydrogen bond donor6
XlogP-2.1
Synonyms4P5DXU1F8Q
C13744
SCHEMBL3682844
3'-O-(4-Benzoyl)benzoyl ATP
AC1Q6S3N
[ Show all ]
Inchi KeyAWJJLYZBWRIBCZ-UGTJMOTHSA-N
Inchi IDInChI=1S/C24H24N5O15P3/c25-21-17-22(27-11-26-21)29(12-28-17)23-19(31)20(16(41-23)10-40-46(36,37)44-47(38,39)43-45(33,34)35)42-24(32)15-8-6-14(7-9-15)18(30)13-4-2-1-3-5-13/h1-9,11-12,16,19-20,23,31H,10H2,(H,36,37)(H,38,39)(H2,25,26,27)(H2,33,34,35)/t16-,19-,20-,23-/m1/s1
PubChem CID115205
ChEMBLN/A
IUPHAR1757
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
553329P2Y purinoceptor 11Q96G91P2RY11Homo sapiens (Human)374

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