SMILES:
COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(-c3cc(C=O)cnc3Nc3cnc(OC)c(F)c3)n2)cc1Molecular Processing
Molecular formula
C32H30FN7O4
Molecular weight
595.64
Exact mass
595.2343
XLogP
5.56
TPSA
124.48
H-bond donors
1
H-bond acceptors
11
Rotatable bonds
12
Heavy atoms
44
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
163.09
Supplementary Information
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