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DocumentationIdentifier: MM362739
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM362739 |
| SMILES |
CCC(O)CCCCCN
|
| InChIKey |
PCHZTDBTASTWTJ-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM291086
Similarity: 0.8387
Similarity to MM291086
| Tanimoto metric | 0.8387 |
|---|---|
| Cosine metric | 0.9124 |
| Dice metric | 0.9123 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155632
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| Tanimoto metric | 0.7846 |
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| Cosine metric | 0.8793 |
| Dice metric | 0.8793 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.89 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM257548
Similarity: 0.7671
Similarity to MM257548
| Tanimoto metric | 0.7671 |
|---|---|
| Cosine metric | 0.8727 |
| Dice metric | 0.8682 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+592 more
