SMILES:
CC(NC(=O)c1cc(Cl)ccc1NC(=O)C1CC(c2ncccc2S(=O)(=O)[O-])=NN1c1ncccc1Cl)C1CC1Molecular Processing
Molecular formula
C26H23Cl2N6O5S-
Molecular weight
602.48
Exact mass
601.0833
XLogP
3.84
TPSA
156.78
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
8
Heavy atoms
40
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
-1
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
148.6
Supplementary Information
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