Nisoldipine (Predicted)

Basic Info

FADB-China IDP0119
Molecular NameNisoldipine
Basis for prediction Nifedipine
Similarity (based on Tanimoto coefficient and ECFP6 fingerprint)0.8721
Similarity (based on Tanimoto coefficient and Daylight fingerprint)0.9590
Similarity (based on MCS)0.8929
2D StructureNo image
SMILESCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC(C)C)C1c1ccccc1[N+](=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 DrugBank, ToxCast & Tox21 Chemicals
PubChem LinkURL Link