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DocumentationIdentifier: MM372381
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM372381 |
| SMILES |
CCCN=CNC(C)CF
|
| InChIKey |
CHEWWEPURKLTHA-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM405726
Similarity: 0.7423
Similarity to MM405726
| Tanimoto metric | 0.7423 |
|---|---|
| Cosine metric | 0.8564 |
| Dice metric | 0.8521 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113500
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| Tanimoto metric | 0.7368 |
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| Cosine metric | 0.8584 |
| Dice metric | 0.8485 |
| MW: | 118.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM240332
Similarity: 0.7021
Similarity to MM240332
| Tanimoto metric | 0.7021 |
|---|---|
| Cosine metric | 0.826 |
| Dice metric | 0.825 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+308 more
