SMILES:
COc1cc2c(cc1F)CCN=C2C1(c2ccccc2Cl)CC1Molecular Processing
Molecular formula
C19H17ClFNO
Molecular weight
329.8
Exact mass
329.0983
XLogP
4.56
TPSA
21.59
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
90.42
Supplementary Information
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