SMILES:
CC(=O)O.CCC[C@@H](NC(=O)N1C/C(=N/OCC)NC[C@H](Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)O)c(N)c1Molecular Processing
Molecular formula
C29H38ClN5O8
Molecular weight
620.1
Exact mass
619.2409
XLogP
3.91
TPSA
192.88
H-bond donors
5
H-bond acceptors
8
Rotatable bonds
10
Heavy atoms
43
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
2
Fraction Csp3
0.414
Molar refractivity
161.28
Supplementary Information
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