Base information

Cat. No.
CAS No.102047-33-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C33H45ClN10O5
Molecular Weight 697.227
Exact Mass 696.326
XLogP3 6.0189
Mr 190.496
PSA 249.43
Sequence -
Atom number 94
Bond number 95
Ring number 3
Rotor number 24
Residues number 0
Canonical smiles NC(=N)NCCC[C@@H](C(=O)N[C@H](C(=O)Nc1ccc2c(c1)cccc2)CCCNC(=N)N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C.Cl

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