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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	5-hydroxytryptamine receptor 1D
Species	Mus musculus (Mouse)
Gene	Htr1d
Synonym	HTRL Htr1db HT1DA Gpcr14 5-HT-1D 5-hydroxytryptamine (serotonin) receptor 1D, G protein-coupled 5-HT1Dalpha 5-HT1D receptor 5-HT1D serotonin receptor 1D [ Show all ]
Disease	N/A for non-human GPCRs
Length	374
Amino acid sequence	MSPPNQSLEGLPQEASNRSLNVTGAWDPEVLQALRISLVVVLSVITLATVLSNAFVLTTILLTKKLHTPANYLIGSLATTDLLVSILVMPISIAYTTTRTWNFGQILCDIWVSSDITCCTASILHLCVIALDRYWAITDALEYSKRRTAGHAAAMIAAVWIISICISIPPLFWRQATAHEEMSDCLVNTSQISYTIYSTCGAFYIPSILLIILYGRIYVAARSRILNPPSLYGKRFTTAQLITGSAGSSLCSLNPSLHESHTHTVGSPLFFNQVKIKLADSILERKRISAARERKATKTLGIILGAFIICWLPFFVVSLVLPICRDSCWIHPALFDFFTWLGYLNSLINPVIYTVFNEDFRQAFQKVVHFRKIS
UniProt	Q61224
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4297
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Carabersat
Molecular formula	C20H20FNO4
IUPAC name	N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-4-fluorobenzamide
Molecular weight	357.381
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.3
Synonyms	HY-U00307 sb 204269-eo ZINC3823825 AC1L4XAZ D05TLP N-((3R,4S)-6-Acetyl-3-hydroxy-2,2-dimethylchroman-4-yl)-4-fluorobenzamide SB-204269-EO Carabersat [INN:BAN] DSSTox_RID_82267 NCGC00254192-01 Tox21_300213 (3R,4S)-6-Acetyl-4-(4-fluorobenzamido)-3,4-dihydro-2,2-dimethyl-3-hydroxy-2H-1-benzopyran CHEMBL39933 K9R83652CK SB-204268 AC1Q4NL5 DSSTox_CID_27319 N-[(3R,4S)-6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-4-fluorobenzamide SB-258339 CAS-184653-84-7 DTXSID6047319 RCLXAPJEFHPYEG-ZWKOTPCHSA-N UNII-K9R83652CK 184653-84-7 CS-7299 N-((3R,4S)-6-Acetyl-3-hydroxy-2,2-dimethyl-4-chromanyl)-p-flurobenzamide SB-204269 DSSTox_GSID_47319 NCGC00247935-01 SCHEMBL261192 [ Show all ]
Inchi Key	RCLXAPJEFHPYEG-ZWKOTPCHSA-N
Inchi ID	InChI=1S/C20H20FNO4/c1-11(23)13-6-9-16-15(10-13)17(18(24)20(2,3)26-16)22-19(25)12-4-7-14(21)8-5-12/h4-10,17-18,24H,1-3H3,(H,22,25)/t17-,18+/m0/s1
PubChem CID	193943
ChEMBL	CHEMBL39933
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Increase	102.0 %	PMID10021946	ChEMBL
Increase	570.0 %	PMID10021946	ChEMBL
Increase	600.0 %	PMID10021946	ChEMBL

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