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DocumentationIdentifier: MM405639
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM405639 |
| SMILES |
COC=CCC(CN)CN
|
| InChIKey |
MXPNRUWOJVKFQA-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM372319
Similarity: 0.7654
Similarity to MM372319
| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8673 |
| Dice metric | 0.8671 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM240290
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Similarity to MM240290
| Tanimoto metric | 0.747 |
|---|---|
| Cosine metric | 0.8557 |
| Dice metric | 0.8552 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM405635
Similarity: 0.7126
Similarity to MM405635
| Tanimoto metric | 0.7126 |
|---|---|
| Cosine metric | 0.8337 |
| Dice metric | 0.8322 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+483 more
