| BioID | bio183823 |
|---|
| Name | GALICAFTOR |
|---|
| ChEMBL ID | CHEMBL4101487 |
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| Molecular Formula | C28H21F4NO7 |
|---|
| Molecular Weight | 559.47 |
|---|
| Molecular Weight (Monoisotopic) | 559.1254 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 2 |
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| Target ID | Tar95 |
|---|
| Target Name | None |
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| Synonyms | ABBV-2222|GALICAFTOR|GLPG-2222|GLPG2222 |
|---|
| Smiles | O=C(O)c1ccc([C@H]2C[C@@H](NC(=O)C3(c4ccc5c(c4)OC(F)(F)O5)CC3)c3ccc(OC(F)F)cc3O2)cc1 |
|---|
| Inchi | InChI=1S/C28H21F4NO7/c29-26(30)37-17-6-7-18-19(13-21(38-22(18)12-17)14-1-3-15(4-2-14)24(34)35)33-25(36)27(9-10-27)16-5-8-20-23(11-16)40-28(31,32)39-20/h1-8,11-12,19,21,26H,9-10,13H2,(H,33,36)(H,34,35)/t19-,21-/m1/s1 |
|---|
| Inchi Key | QVDYQHXNAQHIKH-TZIWHRDSSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 9.0 |
|---|
| Bioactivities | 16.0 |
|---|
| Np Likeness Score | -0.48 |
|---|
| Records Key | ['GALICAFTOR', '22', 'GALICAFTOR'] |
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| Records Name | ['GALICAFTOR', '4-[(2R,4R)-4-({[1-(2,2-Difluoro-1,3-benzodioxol-5-yl)cyclopropyl]-carbonyl}amino)-7-(difluoromethoxy)-3,4-dihydro-2H-chromen-2-yl]benzoic Acid', 'GALICAFTOR'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
