Base information

Cat. No.
CAS No.201930-05-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C28H30N4O4S2
Molecular Weight 550.692
Exact Mass 550.171
XLogP3 6.17
Mr 157.602
PSA 179.3
Sequence -
Atom number 68
Bond number 71
Ring number 4
Rotor number 13
Residues number 0
Canonical smiles COc1cc(NC(=O)[C@H](CSSC[C@@H](C(=O)Nc2cc(OC)c3c(c2)cccc3)N)N)cc2c1cccc2

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