SMILES:
CCC1(CCCCN2CCN(c3ccc(F)cc3)CC2)C(=O)Nc2c(Cl)cc(Cl)cc21.ClMolecular Processing
Molecular formula
C24H29Cl3FN3O
Molecular weight
500.87
Exact mass
499.136
XLogP
6.15
TPSA
35.58
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.458
Molar refractivity
133.21
Supplementary Information
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