SMILES: s1cc(cc1C12N=C(N)N(C)C(=O)C1CN(C2)c1ncccc1OC)-c1cc(ccc1)C#N
pIC50 (BACE-1 inhibition): 8.5228786
Molecular weight: 458.53549
AlogP: 2.8555
H-bond acceptors: 5
H-bond donors: 0
Rotatable bonds: 5
Heavy atom count: 33
Chiral centers: 0
Ring count: 5
Polar surface area: 136.08