Drug Information| Drug ID: | NPD9666 |
| Drug Name: | |
| Molecular Formula: | C9H18N2OS |
| Canonical SMILES: | CC[C@@H]([C@@H](C(=O)N1CSCC1)N)C |
| Standard InCHI: | InChI=1S/C9H18N2OS/c1-3-7(2)8(10)9(12)11-4-5-13-6-11/h7-8H,3-6,10H2,1-2H3/t7-,8-/m0/s1 |
| Standard InCHIKey: | WCRLBFHWFPELKW-YUMQZZPRSA-N |
| Max Developmental Stage: | Clinical (unspecified phase) |
| Max Developmental Stage Source: | TTD |
Structural Similarity Between NPASS Natural Products and NPD9666Similarity 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.
Similar Natural Products High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
| Similarity Level | Similarity Score | Natural Product ID |
|---|---|---|
| Remote Similarity | 0.6753 | NPC327272 |
| Remote Similarity | 0.6556 | NPC117829 |
| Remote Similarity | 0.6316 | NPC322274 |
| Remote Similarity | 0.6203 | NPC209156 |
| Remote Similarity | 0.6 | NPC320221 |
| Remote Similarity | 0.6 | NPC161774 |
| Remote Similarity | 0.6 | NPC266888 |
| Remote Similarity | 0.6 | NPC256312 |
| Remote Similarity | 0.5949 | NPC214532 |
| Remote Similarity | 0.5949 | NPC76297 |
| Remote Similarity | 0.5949 | NPC196007 |
| Remote Similarity | 0.5921 | NPC287693 |
| Remote Similarity | 0.5778 | NPC473495 |
| Remote Similarity | 0.5647 | NPC312315 |
| Remote Similarity | 0.5607 | NPC473819 |