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DocumentationIdentifier: MM359034
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM359034 |
| SMILES |
N#CC#CC(F)CC=CF
|
| InChIKey |
VBTBACABKGMOCA-UHFFFAOYSA-N
|
| MW [Da] |
141.12
Automatically obtained from RDkit software. |
| LogP |
1.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM158416
Similarity: 0.8125
Similarity to MM158416
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 123.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM359032
Similarity: 0.7273
Similarity to MM359032
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8422 |
| Dice metric | 0.8421 |
| MW: | 137.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM359071
Similarity: 0.7054
Similarity to MM359071
| Tanimoto metric | 0.7054 |
|---|---|
| Cosine metric | 0.8272 |
| Dice metric | 0.8272 |
| MW: | 140.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+436 more
