SMILES:
Cn1c(Nc2ccc(Cl)cc2)nc2cc(Oc3ccnc(C#N)c3)ccc21Molecular Processing
Molecular formula
C20H14ClN5O
Molecular weight
375.82
Exact mass
375.0887
XLogP
5.03
TPSA
75.76
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
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
0.05
Molar refractivity
104.47
Supplementary Information
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