Drug ID: | NPD370 |
Drug Name: | Cilexetil |
Molecular Formula: | C10H18O3 |
Canonical SMILES: | CC(OC(=O)OC1CCCCC1)C |
Standard InCHI: | InChI=1S/C10H18O3/c1-8(2)12-10(11)13-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3 |
Standard InCHIKey: | VTDCYOLLYVAJSY-UHFFFAOYSA-N |
Max Developmental Stage: | Phase 3 |
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