SMILES:
CCOc1cccc2c1OC(CNC1CCC(c3c[nH]c4ccc(F)cc34)C1)CO2Molecular Processing
Molecular formula
C24H27FN2O3
Molecular weight
410.49
Exact mass
410.2006
XLogP
4.77
TPSA
55.51
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
114.16
Supplementary Information
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