Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM263396
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263396 |
| SMILES |
C=C(CO)NC(=O)CC#N
|
| InChIKey |
PYFKGXGNZZXISY-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
-0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM263122
Similarity: 0.6795
Similarity to MM263122
| Tanimoto metric | 0.6795 |
|---|---|
| Cosine metric | 0.8093 |
| Dice metric | 0.8092 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263121
Similarity: 0.6774
Similarity to MM263121
| Tanimoto metric | 0.6774 |
|---|---|
| Cosine metric | 0.8079 |
| Dice metric | 0.8077 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM65024
Similarity: 0.6731
Similarity to MM65024
| Tanimoto metric | 0.6731 |
|---|---|
| Cosine metric | 0.8047 |
| Dice metric | 0.8046 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+339 more
