SMILES:
CCC(C)CCCNC(=O)c1cnc(OCC(O)CNCCOc2ccc(C(N)=O)cc2)s1Molecular Processing
Molecular formula
C23H34N4O5S
Molecular weight
478.62
Exact mass
478.225
XLogP
2.21
TPSA
135.8
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
16
Heavy atoms
33
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
127.96
Supplementary Information
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