compound 4
SMILES | COCNCCNS(=O)(=O)c1cc(CCN2CCC(CC2)c2nc(OCC(F)(F)F)c(o2)-c2ccccc2)ccc1OC |
InChIKey | PQVBWXPOZFKRLQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 2 |
Rotatable bonds | 15 |
Molecular weight (Da) | 626.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |