SMILES:
O=[N+]([O-])c1cnc2cccnc2c1NCC1(O)CCCCC1Molecular Processing
Molecular formula
C15H18N4O3
Molecular weight
302.33
Exact mass
302.1379
XLogP
2.65
TPSA
101.18
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
22
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
0.467
Molar refractivity
82.72
Supplementary Information
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