Drug ID: | NPD8842 |
Drug Name: | |
Molecular Formula: | C5H7ClN2O3 |
Canonical SMILES: | N[C@H](C(=O)O)[C@@H]1CC(=NO1)Cl |
Standard InCHI: | InChI=1S/C5H7ClN2O3/c6-3-1-2(11-8-3)4(7)5(9)10/h2,4H,1,7H2,(H,9,10)/t2-,4-/m0/s1 |
Standard InCHIKey: | QAWIHIJWNYOLBE-OKKQSCSOSA-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