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DocumentationIdentifier: MM281009
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281009 |
| SMILES |
CC(CC=CCO)NC=O
|
| InChIKey |
HQJLRNOUUAEBKZ-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM312000
Similarity: 0.8132
Similarity to MM312000
| Tanimoto metric | 0.8132 |
|---|---|
| Cosine metric | 0.9018 |
| Dice metric | 0.897 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69422
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Similarity to MM69422
| Tanimoto metric | 0.7327 |
|---|---|
| Cosine metric | 0.8464 |
| Dice metric | 0.8457 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309984
Similarity: 0.7115
Similarity to MM309984
| Tanimoto metric | 0.7115 |
|---|---|
| Cosine metric | 0.8317 |
| Dice metric | 0.8315 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+228 more
