Drug Information| Drug ID: | NPD9356 |
| Drug Name: | tenilsetam |
| Molecular Formula: | C8H10N2OS |
| Canonical SMILES: | OC1=NCCNC1c1cccs1 |
| Standard InCHI: | InChI=1S/C8H10N2OS/c11-8-7(9-3-4-10-8)6-2-1-5-12-6/h1-2,5,7,9H,3-4H2,(H,10,11) |
| Standard InCHIKey: | BBACKDMGYMXYLE-UHFFFAOYSA-N |
| Max Developmental Stage: | Discontinued |
| Max Developmental Stage Source: | TTD |
Structural Similarity Between NPASS Natural Products and NPD9356Similarity 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 | 0.6552 | NPC468984 |
| Remote Similarity | 0.6496 | NPC166487 |
| Remote Similarity | 0.6471 | NPC300455 |
| Remote Similarity | 0.6364 | NPC101139 |
| Remote Similarity | 0.6291 | NPC13470 |
| Remote Similarity | 0.629 | NPC11466 |
| Remote Similarity | 0.626 | NPC120203 |
| Remote Similarity | 0.6 | NPC471376 |
| Remote Similarity | 0.5972 | NPC300315 |
| Remote Similarity | 0.5902 | NPC226438 |
| Remote Similarity | 0.5868 | NPC2751 |
| Remote Similarity | 0.5792 | NPC143325 |
| Remote Similarity | 0.5789 | NPC190955 |
| Remote Similarity | 0.576 | NPC161972 |
| Remote Similarity | 0.576 | NPC303045 |
| Remote Similarity | 0.5745 | NPC324702 |
| Remote Similarity | 0.5745 | NPC71684 |
| Remote Similarity | 0.5725 | NPC315276 |
| Remote Similarity | 0.5725 | NPC285926 |
| Remote Similarity | 0.5725 | NPC14672 |
| Remote Similarity | 0.5723 | NPC315388 |
| Remote Similarity | 0.5714 | NPC471680 |
| Remote Similarity | 0.5695 | NPC89489 |
| Remote Similarity | 0.5669 | NPC311242 |
| Remote Similarity | 0.5649 | NPC469974 |
| Remote Similarity | 0.5649 | NPC150254 |
| Remote Similarity | 0.5649 | NPC226778 |
| Remote Similarity | 0.5649 | NPC304761 |
| Remote Similarity | 0.5649 | NPC147000 |
| Remote Similarity | 0.5615 | NPC173019 |
| Remote Similarity | 0.561 | NPC470877 |
| Remote Similarity | 0.5603 | NPC299367 |
| TTD | DIB009599 |
| DrugBank | |
| ChEMBL | |
| IUPHAR/BPS | |
| PharmaGKB | |
| KEGG Drug | |
| PubChem CID | |
| ChEBI | |
| CAS Number |
| Molecular Weight | 182.05 |
| ALogP | -0.2695 |
| MLogP | 1.9 |
| XLogP | 1.334 |
| HDA | 3 |
| HBD | 2 |
| Rotatable Bonds | 2 |
| TPSA | 72.86 |
| RO5 Violation | 0 |