Rechol (Predicted)

Basic Info

FADB-China IDP0105
Molecular NameRechol
Basis for prediction Lovastatin
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint)0.8614
Similarity (based on Tanimoto coefficient and Daylight fingerprint)0.9768
Similarity (based on MCS)0.9667
2D StructureNo image
SMILESCCC(C)(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21
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, ToxinDB, T3DB, ToxCast & Tox21 Chemicals
PubChem LinkURL Link