SMILES:
CCCc1c(CNc2ccc(C(=O)NC(CCC(=O)OCC)C(=O)OCC)cc2)cnc2nc(N)nc(N)c12Molecular Processing
Molecular formula
C27H35N7O5
Molecular weight
537.62
Exact mass
537.27
XLogP
2.76
TPSA
184.44
H-bond donors
4
H-bond acceptors
11
Rotatable bonds
13
Heavy atoms
39
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.407
Molar refractivity
147.68
Supplementary Information
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