CCC(C)C(N)C(=O)NC(Cc1c[nH]cn1)C(=O)N1CCCC1C(=O)NC(CO)C(=O)OC
SMILES: CCC(C)C(N)C(=O)NC(Cc1c[nH]cn1)C(=O)N1CCCC1C(=O)NC(CO)C(=O)OC

Molecular Processing

Molecular formula
C21H34N6O6
Molecular weight
466.54
Exact mass
466.254
XLogP
-1.55
TPSA
179.74
H-bond donors
5
H-bond acceptors
8
Rotatable bonds
11
Heavy atoms
33
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
117.42

Supplementary Information

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