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Ligand

NameCHEMBL23096
Molecular formulaC28H28IN3S
IUPAC name3-ethyl-2-[2-(16-ethyl-12-methyl-11,16-diazatetracyclo[8.6.0.03,8.011,15]hexadeca-1,3,5,7,9,14-hexaen-14-yl)ethenyl]-1,3-benzothiazol-3-ium;iodide
Molecular weight565.517
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogPNone
SynonymsN/A
Inchi KeyAHXVWOAPGRNLSW-UHFFFAOYSA-M
Inchi IDInChI=1S/C28H28N3S.HI/c1-4-29-23-12-8-9-13-26(23)32-27(29)15-14-22-16-19(3)31-25-18-21-11-7-6-10-20(21)17-24(25)30(5-2)28(22)31;/h6-15,17-19H,4-5,16H2,1-3H3;1H/q+1;/p-1
PubChem CID44458785
ChEMBLCHEMBL23096
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5966Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407

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