SMILES:
COc1ccc(CN(c2ccncc2)c2nc(-c3ccccc3)nc3ccccc23)cc1Molecular Processing
Molecular formula
C27H22N4O
Molecular weight
418.5
Exact mass
418.1794
XLogP
6.04
TPSA
51.14
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
32
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.074
Molar refractivity
128.05
Supplementary Information
Details werden geladen…
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