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DocumentationIdentifier: MM272989
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272989 |
| SMILES |
CC=C(CC=O)CC(F)F
|
| InChIKey |
OHTZXVMFDTZYQL-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.18
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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MM178522
Similarity: 0.7857
Similarity to MM178522
| Tanimoto metric | 0.7857 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.88 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM41096
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| Tanimoto metric | 0.7449 |
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| Cosine metric | 0.8631 |
| Dice metric | 0.8538 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM150230
Similarity: 0.7143
Similarity to MM150230
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
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| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+713 more
