Monoethyl phthalate (Predicted)

Basic Info

FADB-China IDP1325
Molecular NameMonoethyl phthalate
Basis for prediction DEP
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint)0.7600
Similarity (based on Tanimoto coefficient and Daylight fingerprint)0.9913
Similarity (based on MCS)0.8750
2D StructureNo image
SMILESCCOC(=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 ToxinDB, T3DB
PubChem LinkURL Link