Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM199968
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM199968 |
| SMILES |
CN=C(CO)NCC=O
|
| InChIKey |
DPLBCLGHHCIPQE-UHFFFAOYSA-N
|
| MW [Da] |
130.15
Automatically obtained from RDkit software. |
| LogP |
-1.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM381353
Similarity: 0.8349
Similarity to MM381353
| Tanimoto metric | 0.8349 |
|---|---|
| Cosine metric | 0.9137 |
| Dice metric | 0.91 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM342573
Similarity: 0.728
Similarity to MM342573
| Tanimoto metric | 0.728 |
|---|---|
| Cosine metric | 0.8532 |
| Dice metric | 0.8426 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199803
Similarity: 0.6765
Similarity to MM199803
| Tanimoto metric | 0.6765 |
|---|---|
| Cosine metric | 0.8087 |
| Dice metric | 0.807 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+340 more
