SMILES:
CC(C)(C)c1nc2cc(S(=O)(=O)n3cc(C(=O)NC4CCC4)cn3)ccc2n1CC1CCOCC1Molecular Processing
Molecular formula
C25H33N5O4S
Molecular weight
499.64
Exact mass
499.2253
XLogP
3.48
TPSA
108.11
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.56
Molar refractivity
131.89
Supplementary Information
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