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Name | CHEMBL376981 |
---|---|
Molecular formula | C16H11Cl2NO3 |
IUPAC name | 1-[(3,4-dichlorophenyl)methyl]-5-hydroxyindole-2-carboxylic acid |
Molecular weight | 336.168 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 4.4 |
Synonyms | SCHEMBL6592482 BBRSCGBAIAKATH-UHFFFAOYSA-N 1-(3,4-dichlorobenzyl)-5-hydroxy-1H-indole-2-carboxylic acid BDBM50187039 N-(3,4-Dichlorobenzyl)-5-hydroxyindole-2-carboxylic acid |
Inchi Key | BBRSCGBAIAKATH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H11Cl2NO3/c17-12-3-1-9(5-13(12)18)8-19-14-4-2-11(20)6-10(14)7-15(19)16(21)22/h1-7,20H,8H2,(H,21,22) |
PubChem CID | 9949615 |
ChEMBL | CHEMBL376981 |
IUPHAR | N/A |
BindingDB | 50187039 |
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 |
---|---|---|---|---|---|
19795 | C-C chemokine receptor type 2 | P41597 | CCR2 | Homo sapiens (Human) | 374 |
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