SMILES:
NC1CC(n2cnc3c(Cl)nc(Cl)nc32)C(O)C1OMolecular Processing
Molecular formula
C10H11Cl2N5O2
Molecular weight
304.14
Exact mass
303.029
XLogP
0.13
TPSA
110.08
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
68.99
Supplementary Information
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