الاسم: 18b
SMILES:
CCC(OCc1ncc[nH]1)c1cccc(N)c1Molecular Processing
Molecular formula
C13H17N3O
Molecular weight
231.3
Exact mass
231.1372
XLogP
2.66
TPSA
63.93
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
67.26
Supplementary Information
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