SMILES:
C#Cc1ccc(Nc2cnccc2C(=O)NOCC(O)CO)c(Cl)c1Molecular Processing
Molecular formula
C17H16ClN3O4
Molecular weight
361.79
Exact mass
361.0829
XLogP
1.47
TPSA
103.71
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
93.42
Supplementary Information
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