SMILES:
CC(C)(C)OC(=O)N1CCN(c2ncc(-c3ccc(C#N)cc3)cn2)CC1Molecular Processing
Molecular formula
C20H23N5O2
Molecular weight
365.44
Exact mass
365.1852
XLogP
3.07
TPSA
82.35
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
102.2
Supplementary Information
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