| PDB CCD ID: | A1D8M |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C25 H26 F N3 O5 |
| InChI: | InChI=1S/C25H26FN3O5/c1-3-21(33-18-9-6-16(7-10-18)22(31)15-4-5-15)25-28-23(29-34-25)17-8-11-19(20(26)12-17)24(32)27-14(2)13-30/h6-12,14-15,21,30H,3-5,13H2,1-2H3,(H,27,32)/t14-,21-/m1/s1 |
| InChIKey: | LRXRIKVDAVVQCP-SPLOXXLWSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | CC[C@@H](Oc1ccc(cc1)C(=O)C2CC2)c3onc(n3)c4ccc(C(=O)N[C@H](C)CO)c(F)c4 | | OpenEye OEToolkits 2.0.7 | CCC(c1nc(no1)c2ccc(c(c2)F)C(=O)NC(C)CO)Oc3ccc(cc3)C(=O)C4CC4 | | OpenEye OEToolkits 2.0.7 | CC[C@H](c1nc(no1)c2ccc(c(c2)F)C(=O)N[C@H](C)CO)Oc3ccc(cc3)C(=O)C4CC4 | | CACTVS 3.385 | CC[CH](Oc1ccc(cc1)C(=O)C2CC2)c3onc(n3)c4ccc(C(=O)N[CH](C)CO)c(F)c4 |
|
| Name: | 4-[5-[(1~{R})-1-(4-cyclopropylcarbonylphenoxy)propyl]-1,2,4-oxadiazol-3-yl]-2-fluoranyl-~{N}-[(2~{R})-1-oxidanylpropan-2-yl]benzamide;
Firuglipel |
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