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Ligand

NameCHEMBL2208301
Molecular formulaC30H35N7O3S
IUPAC name(2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-(diaminomethylideneamino)-2-(3-phenothiazin-10-ylpropanoylamino)pentanamide
Molecular weight573.716
Hydrogen bond acceptor6
Hydrogen bond donor5
XlogP2.5
SynonymsBDBM50402459
Inchi KeyLWUANFDWSQXMON-VXKWHMMOSA-N
Inchi IDInChI=1S/C30H35N7O3S/c31-28(39)22(19-20-9-2-1-3-10-20)36-29(40)21(11-8-17-34-30(32)33)35-27(38)16-18-37-23-12-4-6-14-25(23)41-26-15-7-5-13-24(26)37/h1-7,9-10,12-15,21-22H,8,11,16-19H2,(H2,31,39)(H,35,38)(H,36,40)(H4,32,33,34)/t21-,22-/m0/s1
PubChem CID71463272
ChEMBLCHEMBL2208301
IUPHARN/A
BindingDB50402459
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
198384Neuropeptide FF receptor 1Q9GZQ6NPFFR1Homo sapiens (Human)430
198383Neuropeptide FF receptor 2Q9Y5X5NPFFR2Homo sapiens (Human)522

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