SMILES:
Cc1ccc(-c2cc(C(=O)NC(C)CN3CCOCC3)cc(-n3cnnn3)c2)cc1Molecular Processing
Molecular formula
C22H26N6O2
Molecular weight
406.49
Exact mass
406.2117
XLogP
2.09
TPSA
85.17
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
113.51
Supplementary Information
Details werden geladen…
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