Base information

Cat. No.
CAS No.625092-10-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C84H112ClN17O16
Molecular Weight 1651.35
Exact Mass 1649.82
XLogP3 8.4126
Mr 444.336
PSA 491.73
Sequence -
Atom number 230
Bond number 235
Ring number 7
Rotor number 58
Residues number 0
Canonical smiles CC(=O)O.OC[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)N)C)CCCCNC(C)C)CC(C)C)CCCCNC(=O)c1cccnc1)CCCCNC(=O)c1cccnc1)NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc2c(c1)cccc2)NC(=O)C)Cc1ccc(cc1)Cl)Cc1cccnc1

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