SMILES:
N#CCc1nnc2n1-c1sc(Cl)cc1C(c1ccccc1Cl)=NC2Molecular Processing
Molecular formula
C16H9Cl2N5S
Molecular weight
374.26
Exact mass
372.9956
XLogP
4.05
TPSA
66.86
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
94.36
Supplementary Information
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