Cc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CN3CC(C(C)(C)O)C3)n(C)c2n1
SMILES: Cc1nc2ccccc2n1-c1nc(N2CCOCC2)c2nc(CN3CC(C(C)(C)O)C3)n(C)c2n1

Molecular Processing

Molecular formula
C25H32N8O2
Molecular weight
476.59
Exact mass
476.2648
XLogP
2.05
TPSA
97.36
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
35
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.52
Molar refractivity
133.77

Supplementary Information

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