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DocumentationIdentifier: MM448334
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM448334 |
| SMILES |
CON=CCOCCCN
|
| InChIKey |
CTLVNXQVWIHMHD-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
-0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM213270
Similarity: 0.8333
Similarity to MM213270
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 132.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM84322
Similarity: 0.725
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| Tanimoto metric | 0.725 |
|---|---|
| Cosine metric | 0.8414 |
| Dice metric | 0.8406 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM449084
Similarity: 0.6824
Similarity to MM449084
| Tanimoto metric | 0.6824 |
|---|---|
| Cosine metric | 0.8112 |
| Dice metric | 0.8112 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+531 more
