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DocumentationIdentifier: MM343572
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM343572 |
| SMILES |
CCC(CC)C(C)C(N)=O
|
| InChIKey |
FMZVUBQKRMSPGS-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM341014
Similarity: 0.9239
Similarity to MM341014
| Tanimoto metric | 0.9239 |
|---|---|
| Cosine metric | 0.9612 |
| Dice metric | 0.9605 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM343775
Similarity: 0.8911
Similarity to MM343775
| Tanimoto metric | 0.8911 |
|---|---|
| Cosine metric | 0.943 |
| Dice metric | 0.9424 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM343643
Similarity: 0.8286
Similarity to MM343643
| Tanimoto metric | 0.8286 |
|---|---|
| Cosine metric | 0.907 |
| Dice metric | 0.9063 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+558 more
