SMILES:
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(N)=OMolecular Processing
Molecular formula
C46H68N12O8
Molecular weight
917.13
Exact mass
916.5283
XLogP
1.41
TPSA
317.5
H-bond donors
11
H-bond acceptors
10
Rotatable bonds
27
Heavy atoms
66
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
7
Undefined stereo
0
Formal charge
0
Heteroatoms
20
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
247.74
Supplementary Information
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