SMILES:
CC(C)(C)OC(=O)NC1CCN(C(=O)c2ccc(-c3nnc4n3-c3cccnc3Nc3ccccc3-4)cc2)CC1Molecular Processing
Molecular formula
C30H31N7O3
Molecular weight
537.62
Exact mass
537.2488
XLogP
5.18
TPSA
114.27
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
40
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
151.6
Supplementary Information
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