SMILES:
Cc1nsc2c1C(c1ccc(Cl)cc1)=NC1(CC1)c1nnc(C)n1-2Molecular Processing
Molecular formula
C17H14ClN5S
Molecular weight
355.85
Exact mass
355.0658
XLogP
3.83
TPSA
55.96
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
24
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
94.51
Supplementary Information
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