Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM262667
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM262667 |
| SMILES |
N#CC(O)CC(=O)CCO
|
| InChIKey |
WARIVEGGCKMWQU-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142217
Similarity: 0.88
Similarity to MM142217
| Tanimoto metric | 0.88 |
|---|---|
| Cosine metric | 0.9381 |
| Dice metric | 0.9362 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262665
Similarity: 0.8519
Similarity to MM262665
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.92 |
| Dice metric | 0.92 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236780
Similarity: 0.75
Similarity to MM236780
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8586 |
| Dice metric | 0.8571 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+255 more
