SMILES:
N#Cc1ccc(OC2CNCc3occc32)cc1Molecular Processing
Molecular formula
C14H12N2O2
Molecular weight
240.26
Exact mass
240.0899
XLogP
2.37
TPSA
58.19
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
64.94
Supplementary Information
Obteniendo detalles…
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