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Ligand

NameCHEMBL2436617
Molecular formulaC29H32FN5OS
IUPAC name[1-[(2-aminopyridin-4-yl)methyl]-4-fluoropiperidin-4-yl]-(4-phenothiazin-10-ylpiperidin-1-yl)methanone
Molecular weight517.667
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.6
SynonymsBDBM50441512
SCHEMBL12536946
Inchi KeyCSHNEQFLMBVIPC-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H32FN5OS/c30-29(12-17-33(18-13-29)20-21-9-14-32-27(31)19-21)28(36)34-15-10-22(11-16-34)35-23-5-1-3-7-25(23)37-26-8-4-2-6-24(26)35/h1-9,14,19,22H,10-13,15-18,20H2,(H2,31,32)
PubChem CID44816514
ChEMBLCHEMBL2436617
IUPHARN/A
BindingDB50441512
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
49477Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445
49478Histamine H3 receptorP58406Hrh3Mus musculus (Mouse)445

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