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Ligand

NameCHEMBL445384
Molecular formulaC11H14N6O2S2
IUPAC name2-[4-[6-(methanesulfonamidomethyl)pyridin-2-yl]-1,3-thiazol-2-yl]guanidine
Molecular weight326.393
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP-0.7
SynonymsN-[[6-[2-[(Diaminomethylene)amino]-4-thiazolyl]-2-pyridinyl]methyl]methanesulfonamide
SCHEMBL9297632
2-(diaminomethyleneamino)-4-(6-methanesulfonylaminomethylpyridin-2-yl)thiazole
AFEDUCTXZBXLMF-UHFFFAOYSA-N
Inchi KeyAFEDUCTXZBXLMF-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H14N6O2S2/c1-21(18,19)14-5-7-3-2-4-8(15-7)9-6-20-11(16-9)17-10(12)13/h2-4,6,14H,5H2,1H3,(H4,12,13,16,17)
PubChem CID10314303
ChEMBLCHEMBL445384
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
4079Histamine H2 receptorP47747HRH2Cavia porcellus (Guinea pig)359

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