Monomethyl phthalate (Predicted)

Basic Info

FADB-China IDP1324
Molecular NameMonomethyl phthalate
Basis for prediction DEP
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint)0.6042
Similarity (based on Tanimoto coefficient and Daylight fingerprint)0.9134
Similarity (based on MCS)0.8125
2D StructureNo image
SMILESCOC(=O)c1ccccc1C(=O)O
CFM-ID 3.0 (Copy SMILES to the website's input box)URL Link
Update DateJul 30, 2019 14:16

References

TitleData Sources
Source National Health Commission of the People's Republic of China, T3DB, ToxCast & Tox21 Chemicals
PubChem LinkURL Link