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| Ligand Name: 4-{cyclopentyl[(pyrazin-2-yl)methyl]amino}-6-(morpholin-4-yl)-1,3,5-triazine-2-carbonitrile |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB367 |
PubChem:
155521458
|
Synonym(s):
- chembl4450100
- bdbm50517906
show 1 synonym(s)
|
| DrugBank: - |
ChEMBL: CHEMBL4450100 |
| Canonical SMILES: c1nccnc1CN(C2CCCC2)c3nc(C#N)nc(n3)N4CCOCC4 |
| Standard InChI: InChI=1S/C18H22N8O/c19-11-16-22-17(25-7-9-27-10-8-25)24-18(23-16)26(15-3-1-2-4-15)13-14-12-20-5-6-21-14/h5-6,12,15H,1-4,7-10,13H2 |
| Molecular Formula: C18H22N8O |
Mol. Weight: 366.19165 |
logP: 1.31908 |
| HBD: 0 | HBA: 9 |
| #Rotatable Bonds: 5 | TPSA: 103.95 |