Barium nitrate (Predicted)

Basic Info

FADB-China IDP1489
Molecular NameBarium nitrate
Basis for prediction Nitrate
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint)0.6154
Similarity (based on Tanimoto coefficient and Daylight fingerprint)1.0000
Similarity (based on MCS)0.4444
2D StructureNo image
SMILESO=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ba+2]
CFM-ID 3.0 (Copy SMILES to the website's input box)URL Link
Update DateJul 30, 2019 14:16

References

TitleData Sources
Source HPV EPA Chemicals, ToxCast & Tox21 Chemicals
PubChem LinkURL Link