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Ligand

NameCHEMBL181273
Molecular formulaC27H30Cl2N4O2
IUPAC name[4-[(3S,4S)-4-[(3,4-dichlorophenyl)methyl]-3-methoxypiperidin-1-yl]piperidin-1-yl]-(1,8-naphthyridin-2-yl)methanone
Molecular weight513.463
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP5.4
SynonymsBDBM50161432
SCHEMBL13407639
[(3S,4S)-4-(3,4-Dichloro-benzyl)-3-methoxy-[1,4'''']bipiperidinyl-1''''-yl]-[1,8]naphthyridin-2-yl-methanone
Inchi KeyAXAAKILJQSGHDI-CJFMBICVSA-N
Inchi IDInChI=1S/C27H30Cl2N4O2/c1-35-25-17-33(12-8-20(25)15-18-4-6-22(28)23(29)16-18)21-9-13-32(14-10-21)27(34)24-7-5-19-3-2-11-30-26(19)31-24/h2-7,11,16,20-21,25H,8-10,12-15,17H2,1H3/t20-,25-/m1/s1
PubChem CID11283679
ChEMBLCHEMBL181273
IUPHARN/A
BindingDB50161432
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
16489C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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