SMILES:
CCc1cncc(-c2cc3c(cn2)cnn3-c2ccc(C3CC3)c(N3CCC[C@H](N)C3)n2)c1Molecular Processing
Molecular formula
C26H29N7
Molecular weight
439.57
Exact mass
439.2484
XLogP
4.24
TPSA
85.75
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
33
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
130.67
Supplementary Information
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