SMILES:
O=C(c1cc2ncc(Cl)cn2n1)N1CCc2occc2C1Molecular Processing
Molecular formula
C14H11ClN4O2
Molecular weight
302.72
Exact mass
302.0571
XLogP
2.17
TPSA
63.64
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
21
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
75.15
Supplementary Information
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