| PDB CCD ID: | BK2 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C19 H19 N5 |
| InChI: | InChI=1S/C19H19N5/c1-19(2,3)24-18-15(17(20)21-11-22-18)16(23-24)14-9-8-12-6-4-5-7-13(12)10-14/h4-11H,1-3H3,(H2,20,21,22) |
| InChIKey: | ILKDWZKZLIHMFM-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.0 | CC(C)(C)n1c2c(c(n1)c3ccc4ccccc4c3)c(ncn2)N | | CACTVS 3.352 | CC(C)(C)n1nc(c2ccc3ccccc3c2)c4c(N)ncnc14 | | ACDLabs 11.02 | n1c(c2c(nc1)n(nc2c4cc3ccccc3cc4)C(C)(C)C)N |
|
| Name: | 1-tert-butyl-3-naphthalen-2-yl-1H-pyrazolo[3,4-d]pyrimidin-4-amine;
4-Amino-1-tert-butyl-3-(2-naphthyl)pyrazolo[3,4-d]pyrimidine |
| ChEMBL: | CHEMBL1231371 |
| ZINC: | ZINC000013831194 |
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