Drug ID: | NPD1654 |
Drug Name: | |
Molecular Formula: | C15H17Cl2NO2 |
Canonical SMILES: | CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)c1cc(Cl)cc(c1)Cl |
Standard InCHI: | InChI=1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3/t12-,13+,14? |
Standard InCHIKey: | MNJNPLVXBISNSX-PBWFPOADSA-N |
Max Developmental Stage: | Clinical (unspecified phase) |
Max Developmental Stage Source: | TTD |
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