SMILES:
CNc1nnc(NCCCOc2cccc(CN3CCCCC3)c2)o1Molecular Processing
Molecular formula
C18H27N5O2
Molecular weight
345.45
Exact mass
345.2165
XLogP
2.98
TPSA
75.45
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
98.02
Supplementary Information
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