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DocumentationIdentifier: MM253194
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253194 |
| SMILES |
C=CCC(O)CC=C(C)F
|
| InChIKey |
IHNAXWFJVPTXJB-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
2.19
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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MM146286
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| Tanimoto metric | 0.9111 |
|---|---|
| Cosine metric | 0.9545 |
| Dice metric | 0.9535 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM253163
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| Tanimoto metric | 0.7736 |
|---|---|
| Cosine metric | 0.8731 |
| Dice metric | 0.8723 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM255887
Similarity: 0.7523
Similarity to MM255887
| Tanimoto metric | 0.7523 |
|---|---|
| Cosine metric | 0.8601 |
| Dice metric | 0.8586 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+741 more
