SMILES:
Cc1nc(-c2ccccc2)c(C(=O)N2C(C)CCCC2CNC(=O)c2cccc3cccnc23)s1Molecular Processing
Molecular formula
C28H28N4O2S
Molecular weight
484.63
Exact mass
484.1933
XLogP
5.48
TPSA
75.19
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
139.63
Supplementary Information
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