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DocumentationIdentifier: MM238369
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM238369 |
| SMILES |
CC(C)C=C(F)CNC=N
|
| InChIKey |
BBHNLUKCKXMYEH-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM158832
Similarity: 0.8416
Similarity to MM158832
| Tanimoto metric | 0.8416 |
|---|---|
| Cosine metric | 0.9174 |
| Dice metric | 0.914 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM89134
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| Tanimoto metric | 0.7025 |
|---|---|
| Cosine metric | 0.8254 |
| Dice metric | 0.8252 |
| MW: | 141.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.95 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM265616
Similarity: 0.6746
Similarity to MM265616
| Tanimoto metric | 0.6746 |
|---|---|
| Cosine metric | 0.8064 |
| Dice metric | 0.8057 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+308 more
