SMILES:
Cc1csc2c(NN3CCCCC3)nc(Cl)nc12Molecular Processing
Molecular formula
C12H15ClN4S
Molecular weight
282.8
Exact mass
282.0706
XLogP
3.47
TPSA
41.05
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
76.21
Supplementary Information
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