Cc1ccc(C(=O)Nc2ccc(Cn3nc(CC(=O)O)c4ccccc43)cc2)cn1
SMILES: Cc1ccc(C(=O)Nc2ccc(Cn3nc(CC(=O)O)c4ccccc43)cc2)cn1

Molecular Processing

Molecular formula
C23H20N4O3
Molecular weight
400.44
Exact mass
400.1535
XLogP
3.67
TPSA
97.11
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
113.54

Supplementary Information

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