SMILES:
Cc1cc(NSc2ccccc2[N+](=O)[O-])ccc1Oc1ncc(Cl)cn1Molecular Processing
Molecular formula
C17H13ClN4O3S
Molecular weight
388.84
Exact mass
388.0397
XLogP
5.26
TPSA
90.18
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
100.87
Supplementary Information
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