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Name | Relaxin receptor 1 |
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Species | Homo sapiens (Human) |
Gene | RXFP1 |
Synonym | Relaxin family peptide receptor 1 RX1 relaxin/insulin like family peptide receptor 1 relaxin receptor 1 RXFPR1 [ Show all ] |
Disease | Acute heart failure |
Length | 757 |
Amino acid sequence | MTSGSVFFYILIFGKYFSHGGGQDVKCSLGYFPCGNITKCLPQLLHCNGVDDCGNQADEDNCGDNNGWSLQFDKYFASYYKMTSQYPFEAETPECLVGSVPVQCLCQGLELDCDETNLRAVPSVSSNVTAMSLQWNLIRKLPPDCFKNYHDLQKLYLQNNKITSISIYAFRGLNSLTKLYLSHNRITFLKPGVFEDLHRLEWLIIEDNHLSRISPPTFYGLNSLILLVLMNNVLTRLPDKPLCQHMPRLHWLDLEGNHIHNLRNLTFISCSNLTVLVMRKNKINHLNENTFAPLQKLDELDLGSNKIENLPPLIFKDLKELSQLNLSYNPIQKIQANQFDYLVKLKSLSLEGIEISNIQQRMFRPLMNLSHIYFKKFQYCGYAPHVRSCKPNTDGISSLENLLASIIQRVFVWVVSAVTCFGNIFVICMRPYIRSENKLYAMSIISLCCADCLMGIYLFVIGGFDLKFRGEYNKHAQLWMESTHCQLVGSLAILSTEVSVLLLTFLTLEKYICIVYPFRCVRPGKCRTITVLILIWITGFIVAFIPLSNKEFFKNYYGTNGVCFPLHSEDTESIGAQIYSVAIFLGINLAAFIIIVFSYGSMFYSVHQSAITATEIRNQVKKEMILAKRFFFIVFTDALCWIPIFVVKFLSLLQVEIPGTITSWVVIFILPINSALNPILYTLTTRPFKEMIHRFWYNYRQRKSMDSKGQKTYAPSFIWVEMWPLQEMPPELMKPDLFTYPCEMSLISQSTRLNSYS |
UniProt | Q9HBX9 |
Protein Data Bank | 2jm4 |
GPCR-HGmod model | N/A |
3D structure model | This structure is from PDB ID 2jm4. |
BioLiP | BL0101296 |
Therapeutic Target Database | T73696 |
ChEMBL | CHEMBL1293316 |
IUPHAR | 351 |
DrugBank | N/A |
Name | AC1MJZWA |
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Molecular formula | C15H19N3O2S2 |
IUPAC name | 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(oxolan-2-ylmethyl)acetamide |
Molecular weight | 337.456 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.9 |
Synonyms | 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(oxolan-2-ylmethyl)acetamide MCULE-2609745293 SMR001246174 CHEMBL1531505 2-({5,6-dimethylthieno[2,3-d]pyrimidin-4-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide [ Show all ] |
Inchi Key | GYWTWJMLENCDOF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C15H19N3O2S2/c1-9-10(2)22-15-13(9)14(17-8-18-15)21-7-12(19)16-6-11-4-3-5-20-11/h8,11H,3-7H2,1-2H3,(H,16,19) |
PubChem CID | 3146230 |
ChEMBL | CHEMBL1531505 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Potency | 3887.7 nM | PubChem BioAssay data set | ChEMBL |
Potency | 15848.9 nM | PubChem BioAssay data set | ChEMBL |
Potency | 19438.4 nM | PubChem BioAssay data set | ChEMBL |
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