SMILES:
CC1CN(C)c2c(Cl)ccc3c(=O)c(C(=O)O)cn1c23Molecular Processing
Molecular formula
C14H13ClN2O3
Molecular weight
292.72
Exact mass
292.0615
XLogP
2.36
TPSA
62.54
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
78.16
Supplementary Information
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