SMILES:
COc1nccc(N[C@H]2CC[C@@H](C(C)(C)CC(C)(C)C)CC2)c1OCMolecular Processing
Molecular formula
C21H36N2O2
Molecular weight
348.53
Exact mass
348.2777
XLogP
5.53
TPSA
43.38
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.762
Molar refractivity
104.56
Supplementary Information
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