SMILES:
Cc1cccc2cc(Cn3ccc(=O)c4c(N)ncnc43)c(-c3ccccc3Cl)nc12Molecular Processing
Molecular formula
C24H18ClN5O
Molecular weight
427.9
Exact mass
427.12
XLogP
4.6
TPSA
86.69
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
31
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
124.24
Supplementary Information
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