SMILES:
Cc1cccnc1CN(Cc1cccc2c1ncn2C(=O)OC(C)(C)C)C1CCN(C(=O)OC(C)(C)C)CC1Molecular Processing
Molecular formula
C30H41N5O4
Molecular weight
535.69
Exact mass
535.3159
XLogP
5.92
TPSA
89.79
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
39
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
150.41
Supplementary Information
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