SMILES:
Cc1nnc(-c2ccc(Oc3cc(OC4CCN(C)C4=O)cc(C(=O)Nc4nnc(C5CC5)s4)c3)cc2)o1Molecular Processing
Molecular formula
C26H24N6O5S
Molecular weight
532.58
Exact mass
532.1529
XLogP
4.43
TPSA
132.57
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
8
Heavy atoms
38
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
137.49
Supplementary Information
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