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Name | CHEMBL464509 |
---|---|
Molecular formula | C20H23N5O2S |
IUPAC name | 2-hydroxy-N,N-dimethyl-3-[[4-[[(1R)-1-phenylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]benzamide |
Molecular weight | 397.497 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 4.6 |
Synonyms | BDBM50248547 N,N-Dimethyl-2-hydroxy-3-[4-[[(R)-1-phenylpropyl]amino]-1,2,5-thiadiazole-3-ylamino]benzamide (R)-2-hydroxy-N,N-dimethyl-3-(4-(1-phenylpropylamino)-1,2,5-thiadiazol-3-ylamino)benzamide SCHEMBL13208124 |
Inchi Key | BIKNKROBNQQGKU-OAHLLOKOSA-N |
Inchi ID | InChI=1S/C20H23N5O2S/c1-4-15(13-9-6-5-7-10-13)21-18-19(24-28-23-18)22-16-12-8-11-14(17(16)26)20(27)25(2)3/h5-12,15,26H,4H2,1-3H3,(H,21,23)(H,22,24)/t15-/m1/s1 |
PubChem CID | 135814570 |
ChEMBL | CHEMBL464509 |
IUPHAR | N/A |
BindingDB | 50248547 |
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 |
---|---|---|---|---|---|
558028 | C-X-C chemokine receptor type 1 | P25024 | CXCR1 | Homo sapiens (Human) | 350 |
558027 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
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