SMILES:
CN1CC(NC(=O)N2CCc3cnc(NC4CCOCC4)nc3C2)C(Oc2ccc(Cl)c(F)c2)C1Molecular Processing
Molecular formula
C24H30ClFN6O3
Molecular weight
504.99
Exact mass
504.2052
XLogP
2.69
TPSA
91.85
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.542
Molar refractivity
129.25
Supplementary Information
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