Base information

Cat. No.
CAS No.521-31-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H7N3O2
Molecular Weight 177.16
Exact Mass 177.054
XLogP3 0.3798
Mr 49.5938
PSA 91.74
Sequence -
Atom number 20
Bond number 21
Ring number 2
Rotor number 0
Residues number 0
Canonical smiles Nc1cccc2c1c(=O)[nH][nH]c2=O

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