SMILES:
Clc1nc(N2CCCC2)c2nc(Cl)c(Cl)nc2n1Molecular Processing
Molecular formula
C10H8Cl3N5
Molecular weight
304.57
Exact mass
302.9845
XLogP
2.98
TPSA
54.8
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
71.61
Supplementary Information
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