4-Chlorobenzoic Acid (Predicted)

Basic Info

FADB-China IDP1184
Molecular Name4-Chlorobenzoic Acid
Basis for prediction Benzoic acid
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint)0.5424
Similarity (based on Tanimoto coefficient and Daylight fingerprint)0.7586
Similarity (based on MCS)0.9000
2D StructureNo image
SMILESO=C(O)c1ccc(Cl)cc1
CFM-ID 3.0 (Copy SMILES to the website's input box)URL Link
Update DateJul 30, 2019 14:16

References

TitleData Sources
Source DrugBank, T3DB, OpenFoodTox, ToxCast & Tox21 Chemicals
PubChem LinkURL Link