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DocumentationIdentifier: MM274172
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM274172 |
| SMILES |
C=CCC(C=C(F)F)=CF
|
| InChIKey |
ATNALGOBRRXVME-UHFFFAOYSA-N
|
| MW [Da] |
148.13
Automatically obtained from RDkit software. |
| LogP |
3.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178703
Similarity: 0.7742
Similarity to MM178703
| Tanimoto metric | 0.7742 |
|---|---|
| Cosine metric | 0.8799 |
| Dice metric | 0.8727 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM275900
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| Tanimoto metric | 0.6435 |
|---|---|
| Cosine metric | 0.7832 |
| Dice metric | 0.7831 |
| MW: | 150.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM200383
Similarity: 0.6429
Similarity to MM200383
| Tanimoto metric | 0.6429 |
|---|---|
| Cosine metric | 0.7922 |
| Dice metric | 0.7826 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+164 more
