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Ligand

Name671200-24-1
Molecular formulaC16H19N3O2S2
IUPAC nameN-(oxolan-2-ylmethyl)-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide
Molecular weight349.467
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.8
SynonymsMCULE-4459871549
AKOS016403179
N-[(oxolan-2-yl)methyl]-2-{7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraen-12-ylsulfanyl}acetamide
CBKinase1_017622
Z20228734
[ Show all ]
Inchi KeyGXCCSRFNIZFAJX-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H19N3O2S2/c20-13(17-7-10-3-2-6-21-10)8-22-15-14-11-4-1-5-12(11)23-16(14)19-9-18-15/h9-10H,1-8H2,(H,17,20)
PubChem CID2950264
ChEMBLCHEMBL1429474
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
107461Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
107460Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
107459Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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