SMILES:
CCCCCCCOc1ccc2nc([C@@](C)(N)CO)ncc2c1Molecular Processing
Molecular formula
C18H27N3O2
Molecular weight
317.43
Exact mass
317.2103
XLogP
3.15
TPSA
81.26
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
92.42
Supplementary Information
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