SMILES:
COc1ccc(C2(CCO)CCNC2)cc1OCMolecular Processing
Molecular formula
C14H21NO3
Molecular weight
251.33
Exact mass
251.1521
XLogP
1.32
TPSA
50.72
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
70.41
Supplementary Information
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