SMILES:
O=C1CCN(c2ccc3ncc(Cc4ccc5ncccc5c4)n3n2)CC1Molecular Processing
Molecular formula
C21H19N5O
Molecular weight
357.42
Exact mass
357.159
XLogP
3.04
TPSA
63.39
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
27
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
103.99
Supplementary Information
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