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GPCR

NameVasopressin V2 receptor
SpeciesSus scrofa (Pig)
GeneAVPR2
SynonymAntidiuretic hormone receptor
AVPR V2
Renal-type arginine vasopressin receptor
V2R
DiseaseN/A for non-human GPCRs
Length370
Amino acid sequenceMLRATTSAVPRALSWPAAPGNGSEREPLDDRDPLLARVELALLSTVFVAVALSNGLVLGALVRRGRRGRWAPMHVFIGHLCLADLAVALFQVLPQLAWDATYRFRGPDALCRAVKYLQMVGMYASSYMILAMTLDRHRAICRPMLAYRHGGGARWNRPVLVAWAFSLLLSLPQLFIFAQRDVGDGSGVLDCWASFAEPWGLRAYVTWIALMVFVAPALGIAACQVLIFREIHTSLVPGPAERAGGHRGGRRAGSPREGARVSAAMAKTARMTLVIVAVYVLCWAPFFLVQLWSVWDPKAPREGPPFVLLMLLASLNSCTNPWIYASFSSSISSELRSLLCCPRRRTPPSLRPQEESCATASSFSARDTSS
UniProtP32307
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3944
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL174907
Molecular formulaC39H57N11O8S2
IUPAC name(4S,7R,10S,13R,16S)-N-[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-7-(2-aminoethyl)-13-benzyl-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-10-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide
Molecular weight872.074
Hydrogen bond acceptor12
Hydrogen bond donor11
XlogP-0.7
SynonymsN/A
Inchi KeyVKKHZYGGEMWFFK-NFTWDBOBSA-N
Inchi IDInChI=1S/C39H57N11O8S2/c1-22(2)32-38(58)47-27(14-16-40)34(54)49-30(37(57)46-26(33(41)53)9-6-17-44-39(42)43)21-60-59-18-15-31(52)45-28(20-24-10-12-25(51)13-11-24)35(55)48-29(36(56)50-32)19-23-7-4-3-5-8-23/h3-5,7-8,10-13,22,26-30,32,51H,6,9,14-21,40H2,1-2H3,(H2,41,53)(H,45,52)(H,46,57)(H,47,58)(H,48,55)(H,49,54)(H,50,56)(H4,42,43,44)/t26-,27+,28-,29+,30+,32-/m0/s1
PubChem CID44386479
ChEMBLCHEMBL174907
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
K bind15300.0 -PMID2940368ChEMBL

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