SMILES:
Cl.O=c1cc(Cl)c2ccc(F)cc2n1CCN1CCC(NCc2ccc3c(c2)OCCO3)CC1Molecular Processing
Molecular formula
C25H28Cl2FN3O3
Molecular weight
508.42
Exact mass
507.1492
XLogP
4.24
TPSA
55.73
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
34
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
2
Fraction Csp3
0.4
Molar refractivity
134.16
Supplementary Information
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