| PDB CCD ID: | 7IH |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C18 H21 N5 O2 |
| InChI: | InChI=1S/C18H21N5O2/c1-10(2)15-9-20-18(25)14-8-13(22-23(14)15)12-5-6-19-16(7-12)21-17(24)11-3-4-11/h5-8,10-11,15H,3-4,9H2,1-2H3,(H,20,25)(H,19,21,24)/t15-/m0/s1 |
| InChIKey: | WBVXVMNKRUXMBF-HNNXBMFYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | CC(C)C1CNC(=O)c2cc(nn12)c1ccnc(NC(=O)C2CC2)c1 | | CACTVS 3.385 | CC(C)[CH]1CNC(=O)c2cc(nn12)c3ccnc(NC(=O)C4CC4)c3 | | CACTVS 3.385 | CC(C)[C@@H]1CNC(=O)c2cc(nn12)c3ccnc(NC(=O)C4CC4)c3 | | OpenEye OEToolkits 2.0.7 | CC(C)[C@@H]1CNC(=O)c2n1nc(c2)c3ccnc(c3)NC(=O)C4CC4 | | OpenEye OEToolkits 2.0.7 | CC(C)C1CNC(=O)c2n1nc(c2)c3ccnc(c3)NC(=O)C4CC4 |
|
| Name: | N-{4-[(7R,8R)-4-oxo-7-(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl]pyridin-2-yl}cyclopropanecarboxamide |
| ChEMBL: | CHEMBL5183804 |
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