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Name | CHEMBL140539 |
---|---|
Molecular formula | C30H24BrNO3 |
IUPAC name | 4-[(1-benzhydryl-5-bromoindol-3-yl)methyl]-3-methoxybenzoic acid |
Molecular weight | 526.43 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 7.4 |
Synonyms | 3-Methoxy-4-(1-benzhydryl-5-bromo-1H-indole-3-ylmethyl)benzoic acid BDBM50136722 SCHEMBL7676157 4-(1-Benzhydryl-5-bromo-1H-indol-3-ylmethyl)-3-methoxy-benzoic acid |
Inchi Key | FECNHWUMLHYCRX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H24BrNO3/c1-35-28-17-23(30(33)34)13-12-22(28)16-24-19-32(27-15-14-25(31)18-26(24)27)29(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-15,17-19,29H,16H2,1H3,(H,33,34) |
PubChem CID | 18373405 |
ChEMBL | CHEMBL140539 |
IUPHAR | N/A |
BindingDB | 50136722 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
76111 | Leukotriene B4 receptor 1 | Q15722 | LTB4R | Homo sapiens (Human) | 352 |
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