SMILES:
Oc1ccc2c3cnc(Nc4ccc(N5CCNCC5)cn4)nc3n(C3CCCC3)c2n1Molecular Processing
Molecular formula
C23H26N8O
Molecular weight
430.52
Exact mass
430.223
XLogP
3.35
TPSA
104.02
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
32
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
124.6
Supplementary Information
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