SMILES:
O=C(O)c1cn(C2CC2F)c2c(Cl)c(N3CCN(CC(=O)N4CCOCC4)CC3)c(F)cc2c1=OMolecular Processing
Molecular formula
C23H25ClF2N4O5
Molecular weight
510.93
Exact mass
510.1482
XLogP
1.76
TPSA
95.32
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
35
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
124.74
Supplementary Information
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