SMILES:
CCCc1nc2cnc3cc(-c4ccccc4)ccc3c2n1CC(C)(C)NS(C)(=O)=OMolecular Processing
Molecular formula
C24H28N4O2S
Molecular weight
436.58
Exact mass
436.1933
XLogP
4.53
TPSA
76.88
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
126.52
Supplementary Information
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