SMILES:
O=c1[nH]c(NCCCN(Cc2ccccc2)c2ccccn2)ncc1Cc1ccncc1Molecular Processing
Molecular formula
C25H26N6O
Molecular weight
426.52
Exact mass
426.2168
XLogP
3.66
TPSA
86.8
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
126.74
Supplementary Information
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