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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL309106
Molecular formula	C33H39N5O5
IUPAC name	2-[4-(dimethylamino)phenyl]-N-[(2S)-2-hydroxy-3-[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]propyl]-1,3-dioxoisoindole-5-carboxamide
Molecular weight	585.705
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	3.6
Synonyms	RWJ-69442 2-(4-Dimethylamino-phenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid {2-hydroxy-3-[4-(2-isopropoxy-phenyl)-piperazin-1-yl]-propyl}-amide SCHEMBL6585005 BDBM50088394
Inchi Key	LQTJOPPTSIYEES-SANMLTNESA-N
Inchi ID	InChI=1S/C33H39N5O5/c1-22(2)43-30-8-6-5-7-29(30)37-17-15-36(16-18-37)21-26(39)20-34-31(40)23-9-14-27-28(19-23)33(42)38(32(27)41)25-12-10-24(11-13-25)35(3)4/h5-14,19,22,26,39H,15-18,20-21H2,1-4H3,(H,34,40)/t26-/m0/s1
PubChem CID	9894665
ChEMBL	CHEMBL309106
IUPHAR	N/A
BindingDB	50088394
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
194150	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
194149	5-hydroxytryptamine receptor 7	P34969	HTR7	Homo sapiens (Human)	479
194147	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
194144	Alpha-1B adrenergic receptor	P35368	ADRA1B	Homo sapiens (Human)	520
194151	Alpha-1D adrenergic receptor	P25100	ADRA1D	Homo sapiens (Human)	572
194154	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
194143	Alpha-2B adrenergic receptor	P19328	Adra2b	Rattus norvegicus (Rat)	453
194155	Alpha-2B adrenergic receptor	P18089	ADRA2B	Homo sapiens (Human)	450
194152	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462
194142	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
194146	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
194148	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467
194145	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487
194153	Histamine H1 receptor	P31389	HRH1	Cavia porcellus (Guinea pig)	488

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