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DocumentationIdentifier: MM292262
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292262 |
| SMILES |
N#CCC(=O)CCNC=O
|
| InChIKey |
MNYXLGPABYZTFT-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
-0.39
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM76920
Similarity: 0.7813
Similarity to MM76920
| Tanimoto metric | 0.7813 |
|---|---|
| Cosine metric | 0.8773 |
| Dice metric | 0.8772 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300427
Similarity: 0.7701
Similarity to MM300427
| Tanimoto metric | 0.7701 |
|---|---|
| Cosine metric | 0.8776 |
| Dice metric | 0.8701 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM33775
Similarity: 0.73
Similarity to MM33775
| Tanimoto metric | 0.73 |
|---|---|
| Cosine metric | 0.8439 |
| Dice metric | 0.8439 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+104 more
