Base information

Cat. No.
CAS No.1371615-56-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C66H68CaF2N4O10
Molecular Weight 1155.34
Exact Mass 1154.45
XLogP3 10.1038
Mr 312.627
PSA 229.24
Sequence -
Atom number 151
Bond number 156
Ring number 8
Rotor number 26
Residues number 0
Canonical smiles O[C@@H](C[C@H](CC(=O)[O-])O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1.O[C@@H](C[C@H](CC(=O)[O-])O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1.[Ca+2]

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