CHEMBL2089351
SMILES | O[C@@H]1[C@H](O)[C@@H]2C[C@@H]2[C@H]1n1cnc2c(NCC(c3ccccc3)c3ccccc3)nc(C#Cc3cccc(Cl)c3)nc21 |
InChIKey | KGWVDIMFQROOQF-KXFVUDLSSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 561.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |