Name: 1-oxide
SMILES:
CN(C)CCNc1nc2cc3c(cc2[n+]([O-])n1)OCC3Molecular Processing
Molecular formula
C13H17N5O2
Molecular weight
275.31
Exact mass
275.1382
XLogP
0.17
TPSA
77.22
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
74.74
Supplementary Information
Details werden geladen…
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