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DocumentationIdentifier: MM291771
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291771 |
| SMILES |
CCNCCC(=O)NCC
|
| InChIKey |
JNKNTVDDUSWEHW-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156117
Similarity: 0.9429
Similarity to MM156117
| Tanimoto metric | 0.9429 |
|---|---|
| Cosine metric | 0.971 |
| Dice metric | 0.9706 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364507
Similarity: 0.8289
Similarity to MM364507
| Tanimoto metric | 0.8289 |
|---|---|
| Cosine metric | 0.9065 |
| Dice metric | 0.9065 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68835
Similarity: 0.825
Similarity to MM68835
| Tanimoto metric | 0.825 |
|---|---|
| Cosine metric | 0.9049 |
| Dice metric | 0.9041 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+624 more
