Base information

Cat. No.
CAS No.1408311-03-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C77H107N23O10S
Molecular Weight 1546.89
Exact Mass 1545.83
XLogP3 9.5198
Mr 427.977
PSA 608.81
Sequence -
Atom number 218
Bond number 225
Ring number 8
Rotor number 57
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1c[nH]c2c1cccc2)CCCNC(=N)N)[C@H](CC)C)Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CS)N)CCCCN)CCCNC(=N)N

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