CCc1nc2c(cnn2CC)c(NC2CCOCC2)c1CNC(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CC4CCN(C)CC4)c3)c2)c1
SMILES: CCc1nc2c(cnn2CC)c(NC2CCOCC2)c1CNC(=O)c1cccc(C(=O)NCc2cccc(-c3cccc(CC4CCN(C)CC4)c3)c2)c1

Molecular Processing

Molecular formula
C44H53N7O3
Molecular weight
727.95
Exact mass
727.421
XLogP
7.02
TPSA
113.41
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
13
Heavy atoms
54
Rings
7
Aromatic rings
5
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
214.63

Supplementary Information

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