Drug Details

Name:

CHEMBL335950

PubChem ID:

10007115

Pathway:

Show KEGG pathways

InChI:

InChI=1S/C31H25N7O2/c39-27(19-23-14-6-13-22-12-4-5-15-24(22)23)32-31-34-28-25(30-33-29(36-38(30)31)26-16-8-18-40-26)20-37(35-28)17-7-11-21-9-2-1-3-10-21/h1-6,8-10,12-16,18,20H,7,11,17,19H2,(H,32,34,35,39)

SMILES:

O=C(Cc1cccc2c1cccc2)Nc1nc2nn(cc2c2n1nc(n2)c1ccco1)CCCc1ccccc1

Properties:

Formula:	C31H25N7O2	Atoms:	40
Molecular Weight:	527.576	Rotatable Bonds:	9
H-bond Acceptors:	9	H-bond Donors:	1
logP:	5.7742

Targets:

Name	Uniprot ID	Source	References	Interaction
Adenosine A3 receptor	AA3R_HUMAN	BindingDB	-	shows
Adenosine receptor A1	AA1R_HUMAN	BindingDB	-	shows
Adenosine receptor A2a	AA2AR_HUMAN	BindingDB	-	shows
Adenosine receptor A2b	AA2BR_HUMAN	BindingDB	-	shows

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Synonyms:

CHEBI:324478

CHEMBL335950

CID 10007115

CID10007115

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