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DocumentationIdentifier: MM364957
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364957 |
| SMILES |
CN=C(N)CCCCC=O
|
| InChIKey |
FFVMCMUCDRSFTR-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM258324
Similarity: 0.7723
Similarity to MM258324
| Tanimoto metric | 0.7723 |
|---|---|
| Cosine metric | 0.8732 |
| Dice metric | 0.8715 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287155
Similarity: 0.6304
Similarity to MM287155
| Tanimoto metric | 0.6304 |
|---|---|
| Cosine metric | 0.779 |
| Dice metric | 0.7733 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM144819
Similarity: 0.6226
Similarity to MM144819
| Tanimoto metric | 0.6226 |
|---|---|
| Cosine metric | 0.7676 |
| Dice metric | 0.7674 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+280 more
