SMILES:
CSc1ncc2cc(-c3c(Cl)ccc(N)c3Cl)c(N)nc2n1Molecular Processing
Molecular formula
C14H11Cl2N5S
Molecular weight
352.25
Exact mass
351.0112
XLogP
3.88
TPSA
90.71
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
93.39
Supplementary Information
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