NC(=O)c1ccc2ncn(-c3cncc(Cl)n3)c2c1
SMILES: NC(=O)c1ccc2ncn(-c3cncc(Cl)n3)c2c1

Molecular Processing

Molecular formula
C12H8ClN5O
Molecular weight
273.68
Exact mass
273.0417
XLogP
1.57
TPSA
86.69
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
70.19

Supplementary Information

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