SMILES:
COC(=O)c1nc(-c2ccc(O)nc2)cc(N)c1ClMolecular Processing
Molecular formula
C12H10ClN3O3
Molecular weight
279.68
Exact mass
279.0411
XLogP
1.87
TPSA
98.33
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
69.89
Supplementary Information
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