Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM61768
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM61768 |
| SMILES |
CNCCC#CC(=O)NC
|
| InChIKey |
NKUKINRACVNWHR-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
-0.65
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM170631
Similarity: 0.9268
Similarity to MM170631
| Tanimoto metric | 0.9268 |
|---|---|
| Cosine metric | 0.9627 |
| Dice metric | 0.962 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM260374
Similarity: 0.8387
Similarity to MM260374
| Tanimoto metric | 0.8387 |
|---|---|
| Cosine metric | 0.913 |
| Dice metric | 0.9123 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM154594
Similarity: 0.8293
Similarity to MM154594
| Tanimoto metric | 0.8293 |
|---|---|
| Cosine metric | 0.9106 |
| Dice metric | 0.9067 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+503 more
