SMILES:
Cc1ccc2ccnc(Nc3ccc(Cl)cn3)c2n1Molecular Processing
Molecular formula
C14H11ClN4
Molecular weight
270.72
Exact mass
270.0672
XLogP
3.73
TPSA
50.7
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
76.8
Supplementary Information
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