Base information

Cat. No.
CAS No.857283-81-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C9H9N3O
Molecular Weight 175.187
Exact Mass 175.075
XLogP3 0.7596
Mr 47.4868
PSA 50.94
Sequence -
Atom number 22
Bond number 23
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles OCc1cccc(n1)n1cccn1

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