Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM453258
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM453258 |
| SMILES |
CC(=O)CCCN(C)C=O
|
| InChIKey |
IAHWMASKLCOYNJ-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM351933
Similarity: 0.759
Similarity to MM351933
| Tanimoto metric | 0.759 |
|---|---|
| Cosine metric | 0.8712 |
| Dice metric | 0.863 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM166017
Similarity: 0.7229
Similarity to MM166017
| Tanimoto metric | 0.7229 |
|---|---|
| Cosine metric | 0.8502 |
| Dice metric | 0.8392 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363731
Similarity: 0.6897
Similarity to MM363731
| Tanimoto metric | 0.6897 |
|---|---|
| Cosine metric | 0.8232 |
| Dice metric | 0.8163 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+217 more
