COc1ccc(C[C@H](NC(=O)c2ccc(NC(=N)N)cc2)C(=O)N2CCN(CC(=O)O)C(=O)[C@@H]2CCCNC(=O)c2ccc(NC(=N)N)cc2)cc1.Cl
SMILES: COc1ccc(C[C@H](NC(=O)c2ccc(NC(=N)N)cc2)C(=O)N2CCN(CC(=O)O)C(=O)[C@@H]2CCCNC(=O)c2ccc(NC(=N)N)cc2)cc1.Cl

Molecular Processing

Molecular formula
C35H43ClN10O7
Molecular weight
751.25
Exact mass
750.3005
XLogP
1.4
TPSA
269.15
H-bond donors
9
H-bond acceptors
8
Rotatable bonds
15
Heavy atoms
53
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
18
Covalent units
2
Fraction Csp3
0.286
Molar refractivity
200.44

Supplementary Information

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