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DocumentationIdentifier: MM291735
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291735 |
| SMILES |
CCCC(=O)CCNCC
|
| InChIKey |
YMOXBYRDZODCGN-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM166359
Similarity: 0.8289
Similarity to MM166359
| Tanimoto metric | 0.8289 |
|---|---|
| Cosine metric | 0.9105 |
| Dice metric | 0.9065 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM364495
Similarity: 0.8077
Similarity to MM364495
| Tanimoto metric | 0.8077 |
|---|---|
| Cosine metric | 0.8963 |
| Dice metric | 0.8936 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM70633
Similarity: 0.7386
Similarity to MM70633
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8497 |
| Dice metric | 0.8497 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+353 more
