Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cnc(OC3CCN(C(=O)OC(C)(C)C)CC3)c3ccccc23)cc1
SMILES: Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2cnc(OC3CCN(C(=O)OC(C)(C)C)CC3)c3ccccc23)cc1

Molecular Processing

Molecular formula
C34H42N6O4
Molecular weight
598.75
Exact mass
598.3268
XLogP
7.45
TPSA
110.61
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
44
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
172.84

Supplementary Information

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