Drug ID: | NPD8615 |
Drug Name: | Sodium Butyrate |
Molecular Formula: | C4H8O2.Na |
Canonical SMILES: | [O-]C(=O)CCC.[Na+] |
Standard InCHI: | InChI=1S/C4H8O2.Na/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1 |
Standard InCHIKey: | MFBOGIVSZKQAPD-UHFFFAOYSA-M |
Max Developmental Stage: | Phase 2 |
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