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DocumentationIdentifier: MM279260
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM279260 |
| SMILES |
CC=CC(=N)NCCCN
|
| InChIKey |
HMNNUCYHHBWRCZ-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM279337
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Similarity to MM279337
| Tanimoto metric | 0.7723 |
|---|---|
| Cosine metric | 0.8715 |
| Dice metric | 0.8715 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM365593
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| Tanimoto metric | 0.7579 |
|---|---|
| Cosine metric | 0.8642 |
| Dice metric | 0.8623 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM251567
Similarity: 0.7573
Similarity to MM251567
| Tanimoto metric | 0.7573 |
|---|---|
| Cosine metric | 0.862 |
| Dice metric | 0.8619 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+400 more
