SMILES:
N#CC1c2ccccc2C(Nc2ccc(Cl)cc2)=NN1C(=O)c1ccccc1Molecular Processing
Molecular formula
C22H15ClN4O
Molecular weight
386.84
Exact mass
386.0934
XLogP
4.83
TPSA
68.49
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
28
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.045
Molar refractivity
109.02
Supplementary Information
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