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Name | CHEMBL425985 |
---|---|
Molecular formula | C22H20ClN5O3S |
IUPAC name | 1-[4-chloro-3-(dimethylsulfamoyl)-2-hydroxyphenyl]-3-cyano-2-(2-phenylphenyl)guanidine |
Molecular weight | 469.944 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 5.0 |
Synonyms | BDBM50193977 1-[4-chloro-3-(dimethylsulfamoyl)-2-hydroxyphenyl]-2-cyano-3-(2-phenylphenyl)guanidine |
Inchi Key | IYZWLQHDOCJREA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H20ClN5O3S/c1-28(2)32(30,31)21-17(23)12-13-19(20(21)29)27-22(25-14-24)26-18-11-7-6-10-16(18)15-8-4-3-5-9-15/h3-13,29H,1-2H3,(H2,25,26,27) |
PubChem CID | 44419449 |
ChEMBL | CHEMBL425985 |
IUPHAR | N/A |
BindingDB | 50193977 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
145128 | C-X-C chemokine receptor type 1 | P25024 | CXCR1 | Homo sapiens (Human) | 350 |
145127 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
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