Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM35651
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM35651 |
| SMILES |
C#CC(=C)C(O)C(N)C#C
|
| InChIKey |
UNHGRSLHKAQKEB-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
-0.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160310
Similarity: 0.8012
Similarity to MM160310
| Tanimoto metric | 0.8012 |
|---|---|
| Cosine metric | 0.8951 |
| Dice metric | 0.8897 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349399
Similarity: 0.6667
Similarity to MM349399
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8 |
| Dice metric | 0.8 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349854
Similarity: 0.6582
Similarity to MM349854
| Tanimoto metric | 0.6582 |
|---|---|
| Cosine metric | 0.7939 |
| Dice metric | 0.7938 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+77 more
