SMILES:
Cc1ccc2nc(NCCCCO)n(N)c(=O)c2c1Molecular Processing
Molecular formula
C13H18N4O2
Molecular weight
262.31
Exact mass
262.143
XLogP
0.6
TPSA
93.17
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
75.7
Supplementary Information
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