SMILES:
COC(=O)CCc1ccc(N2CCN(C3CCN(C(=N)N)CC3)C2=O)cc1Molecular Processing
Molecular formula
C19H27N5O3
Molecular weight
373.46
Exact mass
373.2114
XLogP
1.39
TPSA
102.96
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.526
Molar refractivity
102.74
Supplementary Information
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