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Name | D01PKC |
---|---|
Molecular formula | C22H27Cl2N5S2 |
IUPAC name | N-[(2S)-1-[4-[(3,4-dichlorophenyl)-dimethylidene-lambda6-sulfanyl]piperazin-1-yl]propan-2-yl]-7-methylthieno[3,2-d]pyrimidin-4-amine |
Molecular weight | 496.513 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 7.1 |
Synonyms | GTPL6993 compound 15 [PMID: 18178086] N-[(2S)-1-[4-[(3,4-dichlorophenyl)-dimethylidene-$l^{6}-sulfanyl]piperazin-1-yl]propan-2-yl]-7-methylthieno[3,2-d]pyrimidin-4-amine |
Inchi Key | WBVRCGUUZYPAGR-INIZCTEOSA-N |
Inchi ID | InChI=1S/C22H27Cl2N5S2/c1-15-13-30-21-20(15)25-14-26-22(21)27-16(2)12-28-7-9-29(10-8-28)31(3,4)17-5-6-18(23)19(24)11-17/h5-6,11,13-14,16H,3-4,7-10,12H2,1-2H3,(H,25,26,27)/t16-/m0/s1 |
PubChem CID | 73755255 |
ChEMBL | N/A |
IUPHAR | 6993 |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
555138 | Lysophosphatidic acid receptor 2 | Q9JL06 | Lpar2 | Mus musculus (Mouse) | 348 |
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