Name: 1-oxide
SMILES:
[O-][n+]1nc(NCCN2CCCCC2)nc2ccc3c(c21)CCC3Molecular Processing
Molecular formula
C17H23N5O
Molecular weight
313.41
Exact mass
313.1903
XLogP
1.65
TPSA
67.99
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.588
Molar refractivity
89.3
Supplementary Information
Details werden geladen…
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