| CAS ID: | 1345614-59-6 |
| Molecular Formula: | C27H24N2O5 |
| Molecular Weight: | 456.5 g/mol |
| Monoisotopic Mass: | 456.1685 g/mol |
| Class: | Small Molecule |
| Natural Product: | No |
| Other Names: | |
| Analysis: | Drug repositioning mechanism analysis |
| InChI: | InChI=1S/C27H24N2O5/c1-17-25(28-27(32)33-18(2)20-6-4-3-5-7-20)26(34-29-17)23-14-12-22(13-15-23)21-10-8-19(9-11-21)16-24(30)31/h3-15,18H,16H2,1-2H3,(H,28,32)(H,30,31)/t18-/m1/s1 | See All |
| InChI Key: | LNDDRUPAICPXIN-GOSISDBHSA-N | |
| Smiles: | C[C@@H](OC(=O)Nc1c(C)noc1c2ccc(cc2)c3ccc(CC(=O)O)cc3)c4ccccc4 | See All |
| Molfile: | Download |
| Target ID | Name | Interaction |
|---|---|---|
| T0140 | Lysophosphatidic acid receptor 1 | antagonist |
Reference Record 1
| PubChem: | 46213949 |
| ChEMBL: | CHEMBL2182052 |