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DocumentationIdentifier: MM253343
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM253343 |
| SMILES |
CC=CC(O)CC=C(C)F
|
| InChIKey |
INBHKAFOUCCYHB-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 |
Similar entries
MM146333
Similarity: 0.9022
Similarity to MM146333
| Tanimoto metric | 0.9022 |
|---|---|
| Cosine metric | 0.9498 |
| Dice metric | 0.9486 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM157373
Similarity: 0.7826
Similarity to MM157373
| Tanimoto metric | 0.7826 |
|---|---|
| Cosine metric | 0.8847 |
| Dice metric | 0.878 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM324602
Similarity: 0.7477
Similarity to MM324602
| Tanimoto metric | 0.7477 |
|---|---|
| Cosine metric | 0.8568 |
| Dice metric | 0.8557 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+391 more
