Name: HLA20
SMILES:
C#CCN1CCN(Cc2ccc(O)c3ncccc23)CC1Molecular Processing
Molecular formula
C17H19N3O
Molecular weight
281.36
Exact mass
281.1528
XLogP
1.69
TPSA
39.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
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
0.353
Molar refractivity
83.96
Supplementary Information
Details werden geladen…
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