| PDB CCD ID: | SWK |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C22 H22 F N5 |
| InChI: | InChI=1S/C22H22FN5/c23-21-4-2-1-3-15(21)9-17-12-26-22-20(17)10-16(11-25-22)18-13-27-28(14-18)19-5-7-24-8-6-19/h1-4,10-14,19,24H,5-9H2,(H,25,26) |
| InChIKey: | WTOUTWLHQLMREW-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | Fc1ccccc1Cc2c[nH]c3ncc(cc23)c4cnn(c4)C5CCNCC5 | | OpenEye OEToolkits 2.0.7 | c1ccc(c(c1)Cc2c[nH]c3c2cc(cn3)c4cnn(c4)C5CCNCC5)F |
|
| Name: | 3-[(2-fluorophenyl)methyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1~{H}-pyrrolo[2,3-b]pyridine |
| ChEMBL: | CHEMBL4796908 |
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