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Ligand

NameCHEMBL255401
Molecular formulaC23H27N5O3S
IUPAC nameN-[5-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-2-methoxyphenyl]-4-pyrimidin-5-ylbenzenesulfonamide
Molecular weight453.561
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP2.7
SynonymsN/A
Inchi KeyAHBUGNNVLKBKII-CALCHBBNSA-N
Inchi IDInChI=1S/C23H27N5O3S/c1-16-13-28(14-17(2)26-16)20-6-9-23(31-3)22(10-20)27-32(29,30)21-7-4-18(5-8-21)19-11-24-15-25-12-19/h4-12,15-17,26-27H,13-14H2,1-3H3/t16-,17+
PubChem CID44453070
ChEMBLCHEMBL255401
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
5417Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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