SMILES:
Cn1cc(-c2cccc(-n3ncc4cc(C(C)(C)C)ccc4c3=O)c2CO)cc(Nc2ccc(C(=O)N3CCOCC3)cn2)c1=OMolecular Processing
Molecular formula
C35H36N6O5
Molecular weight
620.71
Exact mass
620.2747
XLogP
4.15
TPSA
131.58
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
46
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
176.88
Supplementary Information
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