SMILES:
O=C(O)C[C@H]1CCc2c1n(Cc1ccc(Cl)cc1)c1c(N3CCCCC3)cc(F)cc21Molecular Processing
Molecular formula
C25H26ClFN2O2
Molecular weight
440.95
Exact mass
440.1667
XLogP
5.98
TPSA
45.47
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
31
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
121.83
Supplementary Information
Details werden geladen…
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