SMILES:
COc1ccc(-n2nc(CCCO)cc2-c2ccc(Cl)cc2)cc1Molecular Processing
Molecular formula
C19H19ClN2O2
Molecular weight
342.83
Exact mass
342.1135
XLogP
4.13
TPSA
47.28
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
95.97
Supplementary Information
Details werden geladen…
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