COc1cc(-c2ccccc2F)c(Cl)cc1C(=O)N1Cc2cccn2Cc2ccccc21
SMILES: COc1cc(-c2ccccc2F)c(Cl)cc1C(=O)N1Cc2cccn2Cc2ccccc21

Molecular Processing

Molecular formula
C26H20ClFN2O2
Molecular weight
446.91
Exact mass
446.1197
XLogP
6.16
TPSA
34.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.115
Molar refractivity
123.89

Supplementary Information

Details werden geladen…

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