名称: 6-phenylamino-nicotinic acid ethyl ester
SMILES:
CCOC(=O)c1ccc(Nc2ccccc2)nc1Molecular Processing
Molecular formula
C14H14N2O2
Molecular weight
242.28
Exact mass
242.1055
XLogP
3
TPSA
51.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
69.92
Supplementary Information
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