SMILES:
CC(C)N1CCC(Oc2ccc3[nH]ncc3c2)CC1Molecular Processing
Molecular formula
C15H21N3O
Molecular weight
259.35
Exact mass
259.1685
XLogP
2.81
TPSA
41.15
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
76.45
Supplementary Information
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