CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C.C[SiH](C)OC(C(C)(C)C)C(NC(=O)CCCC[NH-])(C(O[SiH](C)C)C(C)(C)C)C(O[SiH](C)C)C(C)(C)C
Name: Z-Phe-His-Leu-Val 4-[-tris-(tert.-butyldimethylsilyloxymethyl)-methylaminocarbonyl]-butyl amide
SMILES: CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)O)C(C)C.C[SiH](C)OC(C(C)(C)C)C(NC(=O)CCCC[NH-])(C(O[SiH](C)C)C(C)(C)C)C(O[SiH](C)C)C(C)(C)C

Molecular Processing

Molecular formula
C61H105N8O11Si3-
Molecular weight
1210.81
Exact mass
1209.7216
XLogP
9.04
TPSA
272.2
H-bond donors
7
H-bond acceptors
11
Rotatable bonds
31
Heavy atoms
83
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
7
Undefined stereo
3
Formal charge
-1
Heteroatoms
22
Covalent units
2
Fraction Csp3
0.656
Molar refractivity
337.24

Supplementary Information

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