Base information

Cat. No.
CAS No.1010386-62-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C34H42N3O7S2+
Molecular Weight 668.843
Exact Mass 668.246
XLogP3 7.7001
Mr 188.626
PSA 160.85
Sequence -
Atom number 88
Bond number 91
Ring number 4
Rotor number 13
Residues number 0
Canonical smiles C#CCNC(=O)CCCCCN1c2ccc(cc2C(/C/1=C\C=C\C1=[N+](CC)c2c(C1(C)C)cc(cc2)S(=O)(=O)O)(C)C)S(=O)(=O)O

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