Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM59065
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM59065 |
| SMILES |
CC#CC(C)(CO)NC=N
|
| InChIKey |
OYPOTVWNHRGDOT-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
-0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139498
Similarity: 0.7578
Similarity to MM139498
| Tanimoto metric | 0.7578 |
|---|---|
| Cosine metric | 0.8705 |
| Dice metric | 0.8622 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM178361
Similarity: 0.7031
Similarity to MM178361
| Tanimoto metric | 0.7031 |
|---|---|
| Cosine metric | 0.8385 |
| Dice metric | 0.8257 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM312730
Similarity: 0.669
Similarity to MM312730
| Tanimoto metric | 0.669 |
|---|---|
| Cosine metric | 0.803 |
| Dice metric | 0.8017 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+98 more
