SMILES:
CCN(C)c1nc2c(C(=O)N[C@@H]3CN4CCC3CC4)cccc2o1Molecular Processing
Molecular formula
C18H24N4O2
Molecular weight
328.42
Exact mass
328.1899
XLogP
2.11
TPSA
61.61
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
24
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
93.37
Supplementary Information
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