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Ligand

Name	Thioperamide
Molecular formula	C15H24N4S
IUPAC name	N-cyclohexyl-4-(1H-imidazol-5-yl)piperidine-1-carbothioamide
Molecular weight	292.445
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	2.4
Synonyms	ZINC13108134 106243-16-7 BDBM22914 DTXSID50147555 LS-114470 N-Cyclohexyl-4-(imidazol-4-yl)-1-piperidinecarbothioamide NCGC00024704-02 SCHEMBL2235762 AC1MI071 CCG-205288 II4319BWUI MR 12842 NCGC00015988-03 Tocris-0644 API0007635 CHEMBL260374 Lopac-T-123 N-cyclohexyl-4-(1H-imidazol-5-yl)piperidine-1-carbothioamide NCGC00015988-11 BRD-K63874012-103-01-5 FJZ MolPort-015-163-994 NCGC00015988-01 NCGC00024704-03 AKOS024458593 CHEBI:81391 KS-000001KM N-Cyclohexy-4-(imidazol-4-yl)-1-piperidinecarbothioamide NCGC00015988-04 UNII-II4319BWUI 1-Piperidinecarbothioamide, N-cyclohexyl-4-(1H-imidazol-4-yl)- B6390 D05FYA Lopac0_001214 N-cyclohexyl-4-(3H-imidazol-4-yl)piperidine-1-carbothioamide NCGC00024704-01 C17933 GTPL1267 MolPort-023-275-907 NCGC00015988-02 QKDDJDBFONZGBW-UHFFFAOYSA-N Thioperamide maleate AKOS030228083 L000596 N-Cyclohexyl-4-(1H-imidazol-5-yl)-1-piperidinecarbothioamide NCGC00015988-05 [ Show all ]
Inchi Key	QKDDJDBFONZGBW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
PubChem CID	3035905
ChEMBL	CHEMBL260374
IUPHAR	1267
BindingDB	22914
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

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GLASS ID	Name	UniProt	Gene	Species	Length
280254	5-hydroxytryptamine receptor 1A	P19327	Htr1a	Rattus norvegicus (Rat)	422
280258	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
280256	5-hydroxytryptamine receptor 1D	P28565	Htr1d	Rattus norvegicus (Rat)	374
556565	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
280249	5-hydroxytryptamine receptor 2C	P08909	Htr2c	Rattus norvegicus (Rat)	460
280262	5-hydroxytryptamine receptor 4	O70528	HTR4	Cavia porcellus (Guinea pig)	388
280243	Alpha-1A adrenergic receptor	P43140	Adra1a	Rattus norvegicus (Rat)	466
280245	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
280250	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462
280260	Alpha-2C adrenergic receptor	P22086	Adra2c	Rattus norvegicus (Rat)	458
461637	Beta-2 adrenergic receptor	P10608	Adrb2	Rattus norvegicus (Rat)	418
280261	Cholecystokinin receptor type A	P30551	Cckar	Rattus norvegicus (Rat)	444
280252	D(1A) dopamine receptor	P18901	Drd1	Rattus norvegicus (Rat)	446
556564	D(3) dopamine receptor	P19020	Drd3	Rattus norvegicus (Rat)	446
280240	Delta-type opioid receptor	P33533	Oprd1	Rattus norvegicus (Rat)	372
280242	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487
280247	Histamine H1 receptor	P31389	HRH1	Cavia porcellus (Guinea pig)	488
280244	Histamine H2 receptor	P47747	HRH2	Cavia porcellus (Guinea pig)	359
280263	Histamine H2 receptor	P25021	HRH2	Homo sapiens (Human)	359
280235	Histamine H3 receptor	Q9Y5N1	HRH3	Homo sapiens (Human)	445