Base information

Cat. No.
CAS No.1264-72-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C52H100N16O17S
Molecular Weight 1253.51
Exact Mass 1252.72
XLogP3 1.9632
Mr 340.47
PSA 573.64
Sequence -
Atom number 186
Bond number 185
Ring number 1
Rotor number 32
Residues number 0
Canonical smiles OS(=O)(=O)O.NCCC(C(=O)NC1CCNC(=O)C(NC(=O)C(CCN)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)CCN)CC(C)C)CC(C)C)CCN)C(O)C)NC(=O)C(C(O)C)NC(=O)C(NC(=O)CCCC(CC)C)CCN

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