SMILES:
I.N#Cc1ccc(C=NNC(=N)NN=Cc2ccc(Cl)cc2)cc1Molecular Processing
Molecular formula
C16H14ClIN6
Molecular weight
452.69
Exact mass
452.0013
XLogP
3.31
TPSA
96.42
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0
Molar refractivity
107.21
Supplementary Information
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