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DocumentationIdentifier: MM239347
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM239347 |
| SMILES |
CCCCNC(C)(C)CC
|
| InChIKey |
MFGBPWSFVCIOQG-UHFFFAOYSA-N
|
| MW [Da] |
143.27
Automatically obtained from RDkit software. |
| LogP |
2.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138161
Similarity: 0.875
Similarity to MM138161
| Tanimoto metric | 0.875 |
|---|---|
| Cosine metric | 0.9354 |
| Dice metric | 0.9333 |
| MW: | 129.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM233772
Similarity: 0.8158
Similarity to MM233772
| Tanimoto metric | 0.8158 |
|---|---|
| Cosine metric | 0.9009 |
| Dice metric | 0.8986 |
| MW: | 143.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM226083
Similarity: 0.8116
Similarity to MM226083
| Tanimoto metric | 0.8116 |
|---|---|
| Cosine metric | 0.8963 |
| Dice metric | 0.896 |
| MW: | 143.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+652 more
