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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	Etonitazene
Molecular formula	C22H28N4O3
IUPAC name	2-[2-[(4-ethoxyphenyl)methyl]-5-nitrobenzimidazol-1-yl]-N,N-diethylethanamine
Molecular weight	396.491
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.3
Synonyms	1H-Benzimidazole-1-ethanamine, 2-[(4-ethoxyphenyl)methyl]-N,N-diethyl-5-nitro- 77014-EP2298764A1 Ba 20684 DSSTox_GSID_48919 Etonitazeno [INN-Spanish] L000697 Tox21_112830 1-(2-(Diethylamino)ethyl)-2-(p-ethoxybenzyl)-5-nitrobenzimidazole 2-[2-[(4-ethoxyphenyl)methyl]-5-nitrobenzimidazol-1-yl]-N,N-diethylethanamine 911-65-9 BENZIMIDAZOLE, 1-(2-(DIETHYLAMINO)ETHYL)-2-(p-ETHOXYBENZYL)-5-NITRO- CS-6622 EINECS 213-009-1 etonitazin NIH-7607 {2-[2-(4-Ethoxy-benzyl)-5-nitro-benzoimidazol-1-yl]-ethyl}-diethyl-amine 1H-Benzimidazole-1-ethanamine, 2-((4-ethoxyphenyl)methyl)-N,N-diethyl-5-nitro- 77014-EP2275420A1 AC1Q21HU C22H28N4O3 DEA No. 9624 Etonitazene [INN:BAN:DCF] GTPL1624 PXDBZSCGSQSKST-UHFFFAOYSA-N 2-p-ethoxybenzyl-1-(2-diethylaminoethyl)-5-nitrobenzimidazole 77014-EP2298765A1 Ba-20684 CHEMBL312040 DSSTox_RID_83114 Etonitazenum LS-32849 UNII-9U3GT3353T 1-(2-Diethylaminoethyl)-2-(p-ethoxybenzyl)-5-nitrobenzimidazole 5-23-12-00348 (Beilstein Handbook Reference) 9U3GT3353T Benzimidazole, 1-[2-(diethylamino)ethyl]-2-(p-ethoxybenzyl)-5-nitro- D0U3UM Etobedolum Etonitazine PDSP1_001558 1H-Benzimidazole-1-ethanamine, 2-((4-ethoxyphenyl)methyl)-N,N-diethyl-5-nitro- (9CI) 77014-EP2280008A2 ARC 1G2 CAS-911-65-9 DSSTox_CID_28845 Etonitazeno HY-101645 SCHEMBL25183 2-[2-(4-Ethoxybenzyl)-5-nitro-1H-benzimidazol-1-yl]-N,N-diethylethanamine # 77014-EP2308509A1 BDBM50013847 Ciba 20-684BA DTXSID6048919 Etonitazenum [INN-Latin] NIH 7607 ZINC4215955 AC1L21U9 BRN 0363324 DB01462 Etonitazinum PDSP2_001542 [ Show all ]
Inchi Key	PXDBZSCGSQSKST-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H28N4O3/c1-4-24(5-2)13-14-25-21-12-9-18(26(27)28)16-20(21)23-22(25)15-17-7-10-19(11-8-17)29-6-3/h7-12,16H,4-6,13-15H2,1-3H3
PubChem CID	13493
ChEMBL	CHEMBL312040
IUPHAR	1624
BindingDB	50013847
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
271124	Delta-type opioid receptor	P33533	Oprd1	Rattus norvegicus (Rat)	372
271126	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
461560	Delta-type opioid receptor	P79291	OPRD1	Sus scrofa (Pig)	228
271123	Kappa-type opioid receptor	P41144	OPRK1	Cavia porcellus (Guinea pig)	380
271125	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
271122	Mu-type opioid receptor	Q9MYW9	OPRM1	Macaca mulatta (Rhesus macaque)	400
271127	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400
271128	Mu-type opioid receptor	P33535	Oprm1	Rattus norvegicus (Rat)	398
271129	Mu-type opioid receptor	P97266	OPRM1	Cavia porcellus (Guinea pig)	98

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