SMILES:
Cn1c(C#N)ccc1-c1ccc2c(c1)C1(C=N2)CCCCC1Molecular Processing
Molecular formula
C19H19N3
Molecular weight
289.38
Exact mass
289.1579
XLogP
4.48
TPSA
41.08
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
22
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
88.48
Supplementary Information
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