SMILES:
COC(=O)c1ccc2oc(C(=O)Nc3ccc(Cl)cn3)c(NC(=O)C3CCC(N4CCOCC4=O)CC3)c2n1Molecular Processing
Molecular formula
C26H26ClN5O7
Molecular weight
555.98
Exact mass
555.1521
XLogP
3.27
TPSA
152.96
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
39
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
139.46
Supplementary Information
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