| PDB CCD ID: | TW2 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C15 H13 F N6 |
| InChI: | InChI=1S/C15H13FN6/c1-22-14(19-7-9-4-2-3-5-11(9)16)10(6-17)12-13(18)20-8-21-15(12)22/h2-5,8,19H,7H2,1H3,(H2,18,20,21) |
| InChIKey: | BJAJDULYKUREBF-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | Cn1c2c(c(c1NCc3ccccc3F)C#N)c(ncn2)N | | CACTVS 3.385 | Cn1c(NCc2ccccc2F)c(C#N)c3c(N)ncnc13 |
|
| Name: | 4-amino-6-{[(2-fluorophenyl)methyl]amino}-7-methyl-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile;
4-azanyl-6-[(2-fluorophenyl)methylamino]-7-methyl-pyrrolo[2,3-d]pyrimidine-5-carbonitrile |
| ChEMBL: | CHEMBL5093047 |
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