Base information

Cat. No.
CAS No.177966-62-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C83H144N30O20S
Molecular Weight 1914.29
Exact Mass 1913.09
XLogP3 4.6946
Mr 500.319
PSA 881.3
Sequence -
Atom number 278
Bond number 280
Ring number 3
Rotor number 85
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)NCC(=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)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)CC(=O)N)CCCCN)CCC(=O)N)CCCNC(=N)N)CC(C)C)CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2)CCCCN)CCCNC(=N)N)Cc1ccccc1)C)CCCNC(=N)N

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