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Ligand

NameCHEMBL252428
Molecular formulaC26H27ClF2N4O
IUPAC name[(6aR,9R,10aR)-5-chloro-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-9-yl]-[4-(3,4-difluorophenyl)piperazin-1-yl]methanone
Molecular weight484.976
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.6
SynonymsBDBM50423467
Inchi KeyJRUPWIBSWDLMQK-OMXJDXKCSA-N
Inchi IDInChI=1S/C26H27ClF2N4O/c1-31-14-15(11-18-17-3-2-4-22-24(17)19(13-23(18)31)25(27)30-22)26(34)33-9-7-32(8-10-33)16-5-6-20(28)21(29)12-16/h2-6,12,15,18,23,30H,7-11,13-14H2,1H3/t15-,18-,23-/m1/s1
PubChem CID44447069
ChEMBLCHEMBL252428
IUPHARN/A
BindingDB50423467
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
158431Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
158430Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369

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