Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM52007
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM52007 |
| SMILES |
N#CC=C(C#N)OC=O
|
| InChIKey |
PPFRVRQFLJFZTI-UHFFFAOYSA-N
|
| MW [Da] |
122.08
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM67512
Similarity: 0.6953
Similarity to MM67512
| Tanimoto metric | 0.6953 |
|---|---|
| Cosine metric | 0.8339 |
| Dice metric | 0.8203 |
| MW: | 136.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87283
Similarity: 0.6953
Similarity to MM87283
| Tanimoto metric | 0.6953 |
|---|---|
| Cosine metric | 0.8339 |
| Dice metric | 0.8203 |
| MW: | 136.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51965
Similarity: 0.6577
Similarity to MM51965
| Tanimoto metric | 0.6577 |
|---|---|
| Cosine metric | 0.7939 |
| Dice metric | 0.7935 |
| MW: | 127.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+76 more
