SMILES:
COc1ccc2nc(NC(=O)C(CC3CCCC3)c3ccc(S(=O)(=O)N(CCC(=O)O)Cc4cc5ccccc5o4)cc3)sc2n1Molecular Processing
Molecular formula
C33H34N4O7S2
Molecular weight
662.79
Exact mass
662.1869
XLogP
6.41
TPSA
151.93
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
13
Heavy atoms
46
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
174.42
Supplementary Information
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