SMILES:
CC(C)(C)OC(=O)N1CCC(c2ccn3c(C(=O)O)cnc3c2)CC1Molecular Processing
Molecular formula
C18H23N3O4
Molecular weight
345.4
Exact mass
345.1689
XLogP
3.15
TPSA
84.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
91.93
Supplementary Information
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