Base information

Cat. No.
CAS No.152274-66-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C44H66N14O7S2
Molecular Weight 967.214
Exact Mass 966.468
XLogP3 4.8274
Mr 261.454
PSA 407.88
Sequence -
Atom number 133
Bond number 135
Ring number 3
Rotor number 38
Residues number 0
Canonical smiles CSCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCCNC(=N)N)CCSC)Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CCCNC(=N)N)Cc1ccccc1

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