SMILES:
Cc1cc2c(cn1)cc(-c1cc(Nc3cc(-c4nccs4)no3)ccc1C)c(=O)n2CMolecular Processing
Molecular formula
C23H19N5O2S
Molecular weight
429.51
Exact mass
429.1259
XLogP
5.07
TPSA
85.84
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
31
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
122.79
Supplementary Information
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