CC(C)[Si](Oc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)N[C@H]2CC[C@@H](Oc3ccc4nnc(N5CCCC[C@@H]5C)n4c3)c3ccccc32)cc1CO)(C(C)C)C(C)C
Name: Intermediate 61e
SMILES: CC(C)[Si](Oc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)N[C@H]2CC[C@@H](Oc3ccc4nnc(N5CCCC[C@@H]5C)n4c3)c3ccccc32)cc1CO)(C(C)C)C(C)C

Molecular Processing

Molecular formula
C46H64N8O4Si
Molecular weight
821.16
Exact mass
820.482
XLogP
10.41
TPSA
131.07
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
12
Heavy atoms
59
Rings
7
Aromatic rings
5
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
237.45

Supplementary Information

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