Drug ID: | NPD1611 |
Drug Name: | Acetomenaphthone |
Molecular Formula: | C15H14O4 |
Canonical SMILES: | CC(=O)Oc1cc(C)c(c2c1cccc2)OC(=O)C |
Standard InCHI: | InChI=1S/C15H14O4/c1-9-8-14(18-10(2)16)12-6-4-5-7-13(12)15(9)19-11(3)17/h4-8H,1-3H3 |
Standard InCHIKey: | RYWSYCQQUDFMAU-UHFFFAOYSA-N |
Max Developmental Stage: | Approved |
Max Developmental Stage Source: | ChEMBL |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7