SMILES:
CCc1nc(N)nc(N)c1OCCCOc1ccnc2ccc(F)cc12.Cl.ClMolecular Processing
Molecular formula
C18H22Cl2FN5O2
Molecular weight
430.31
Exact mass
429.1135
XLogP
3.58
TPSA
109.17
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
3
Fraction Csp3
0.278
Molar refractivity
112.04
Supplementary Information
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