SMILES:
CN1C(=O)[C@H]2CCCCN2c2nc(Cl)ncc21Molecular Processing
Molecular formula
C11H13ClN4O
Molecular weight
252.71
Exact mass
252.0778
XLogP
1.47
TPSA
49.33
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
65.44
Supplementary Information
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