SMILES:
Cc1cc(Cl)c(C)n2nc(CCc3nc(N4CCCC4)nn3C)nc12Molecular Processing
Molecular formula
C17H22ClN7
Molecular weight
359.87
Exact mass
359.1625
XLogP
2.51
TPSA
64.14
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
97.33
Supplementary Information
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