Name: compound 12
SMILES:
CCc1cccc2c3c([nH]c12)C(CC)(CC(C)O)OCC3Molecular Processing
Molecular formula
C18H25NO2
Molecular weight
287.4
Exact mass
287.1885
XLogP
3.68
TPSA
45.25
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
85.6
Supplementary Information
Details werden geladen…
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