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DocumentationIdentifier: MM312419
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM312419 |
| SMILES |
C=CCC(CN)(CN)CN
|
| InChIKey |
FHFZKEBKKYRTPB-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM77939
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Similarity to MM77939
| Tanimoto metric | 0.9365 |
|---|---|
| Cosine metric | 0.9677 |
| Dice metric | 0.9672 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309821
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| Tanimoto metric | 0.7763 |
|---|---|
| Cosine metric | 0.876 |
| Dice metric | 0.8741 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM102988
Similarity: 0.746
Similarity to MM102988
| Tanimoto metric | 0.746 |
|---|---|
| Cosine metric | 0.8637 |
| Dice metric | 0.8545 |
| MW: | 113.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+392 more
