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DocumentationIdentifier: MM289558
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM289558 |
| SMILES |
C=C(F)C=CCC#CCC
|
| InChIKey |
RRKYBQZJMMOKFD-UHFFFAOYSA-N
|
| MW [Da] |
138.19
Automatically obtained from RDkit software. |
| LogP |
2.83
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM154330
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| Tanimoto metric | 0.9178 |
|---|---|
| Cosine metric | 0.958 |
| Dice metric | 0.9571 |
| MW: | 124.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM289566
Similarity: 0.8481
Similarity to MM289566
| Tanimoto metric | 0.8481 |
|---|---|
| Cosine metric | 0.9178 |
| Dice metric | 0.9178 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM289571
Similarity: 0.8171
Similarity to MM289571
| Tanimoto metric | 0.8171 |
|---|---|
| Cosine metric | 0.8995 |
| Dice metric | 0.8993 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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