SMILES:
Cc1c(CN2CCN(c3nccnc3-c3ccc(CNC(=O)C4CCOC4)cc3)CC2)cnn1CMolecular Processing
Molecular formula
C26H33N7O2
Molecular weight
475.6
Exact mass
475.2696
XLogP
2.16
TPSA
88.41
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
35
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
133.68
Supplementary Information
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