SMILES:
Cc1ccc(-c2cc(C(=O)NCc3ccc(C)nn3)cc(-c3ncsc3C(C)C)c2)nc1Molecular Processing
Molecular formula
C25H25N5OS
Molecular weight
443.58
Exact mass
443.178
XLogP
5.33
TPSA
80.66
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
32
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
0.24
Molar refractivity
127.55
Supplementary Information
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