SMILES:
Cc1nc(-c2cnc(NCCNc3ccc([N+](=O)[O-])cn3)nc2-c2ccc(Cl)cc2Cl)c[nH]1.Cl.ClMolecular Processing
Molecular formula
C21H20Cl4N8O2
Molecular weight
558.26
Exact mass
556.0463
XLogP
5.82
TPSA
134.55
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
3
Fraction Csp3
0.143
Molar refractivity
142.17
Supplementary Information
Details werden geladen…
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