SMILES:
CC(C)CC(NC(=O)CNC(=O)C(Cc1ccc(O)cc1)NC(=O)C(CO)NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)C(Cc1cnc[nH]1)NC(=O)C1CCC(=O)N1)C(=O)NC(CCCN=C(N)N)C(=O)N1CCCC1C(=O)NCC(N)=O.OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOMolecular Processing
Molecular formula
C77H121N17O25
Molecular weight
1684.91
Exact mass
1683.872
XLogP
-5.25
TPSA
607.39
H-bond donors
18
H-bond acceptors
27
Rotatable bonds
62
Heavy atoms
119
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
8
Undefined stereo
8
Formal charge
0
Heteroatoms
42
Covalent units
2
Fraction Csp3
0.623
Molar refractivity
427.62
Supplementary Information
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