SMILES:
CCCCc1nc2c(N)nc3ccccc3c2n1CCCCNMolecular Processing
Molecular formula
C18H25N5
Molecular weight
311.43
Exact mass
311.211
XLogP
3.25
TPSA
82.75
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
96.35
Supplementary Information
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