Base information

Cat. No.
CAS No.51833-69-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C49H71N13O10
Molecular Weight 1002.17
Exact Mass 1001.54
XLogP3 3.1775
Mr 269.762
PSA 357.55
Sequence -
Atom number 143
Bond number 146
Ring number 4
Rotor number 35
Residues number 0
Canonical smiles CNCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)Cc1[nH]cnc1)[C@H](CC)C)Cc1ccc(cc1)O)C(C)C)CCCN=C(N)N

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