Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM51316
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM51316 |
| SMILES |
N#CCN(C=O)CC=O
|
| InChIKey |
FRSDELRUNASFPS-UHFFFAOYSA-N
|
| MW [Da] |
126.12
Automatically obtained from RDkit software. |
| LogP |
-0.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM305491
Similarity: 0.7374
Similarity to MM305491
| Tanimoto metric | 0.7374 |
|---|---|
| Cosine metric | 0.8587 |
| Dice metric | 0.8488 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM23680
Similarity: 0.7123
Similarity to MM23680
| Tanimoto metric | 0.7123 |
|---|---|
| Cosine metric | 0.844 |
| Dice metric | 0.832 |
| MW: | 112.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51317
Similarity: 0.6753
Similarity to MM51317
| Tanimoto metric | 0.6753 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.8062 |
| MW: | 123.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+83 more
