Base information

Cat. No.
CAS No.229961-08-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C64H103N21O14S
Molecular Weight 1422.7
Exact Mass 1421.77
XLogP3 2.26
Mr 380.462
PSA 581.08
Sequence -
Atom number 203
Bond number 207
Ring number 5
Rotor number 55
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1ccccc1)CCSC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N)CCCNC(=N)N)CC(C)C)CO)Cc1nc[nH]c1

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