Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM284037
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM284037 |
| SMILES |
CC(=CC=O)OC=CC#N
|
| InChIKey |
GHCYGIAERWGKQU-UHFFFAOYSA-N
|
| MW [Da] |
137.14
Automatically obtained from RDkit software. |
| LogP |
1.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM159123
Similarity: 0.7978
Similarity to MM159123
| Tanimoto metric | 0.7978 |
|---|---|
| Cosine metric | 0.8932 |
| Dice metric | 0.8875 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM71395
Similarity: 0.78
Similarity to MM71395
| Tanimoto metric | 0.78 |
|---|---|
| Cosine metric | 0.8764 |
| Dice metric | 0.8764 |
| MW: | 137.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM169001
Similarity: 0.7528
Similarity to MM169001
| Tanimoto metric | 0.7528 |
|---|---|
| Cosine metric | 0.8676 |
| Dice metric | 0.859 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+272 more
