Base information

Cat. No.
CAS No.196808-85-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C50H63N13O7
Molecular Weight 958.118
Exact Mass 957.497
XLogP3 5.2878
Mr 262.587
PSA 329.99
Sequence -
Atom number 133
Bond number 138
Ring number 6
Rotor number 31
Residues number 0
Canonical smiles NCCCC[C@@H](C(=O)N)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](Cc1c(C)[nH]c2c1cccc2)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](N)C)C

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