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DocumentationIdentifier: MM345754
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM345754 |
| SMILES |
CCC(CF)CC=C(F)F
|
| InChIKey |
KDOYNVDSWVVRGM-UHFFFAOYSA-N
|
| MW [Da] |
152.16
Automatically obtained from RDkit software. |
| LogP |
3.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199418
Similarity: 0.8125
Similarity to MM199418
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM387970
Similarity: 0.7558
Similarity to MM387970
| Tanimoto metric | 0.7558 |
|---|---|
| Cosine metric | 0.8625 |
| Dice metric | 0.8609 |
| MW: | 146.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM146276
Similarity: 0.7125
Similarity to MM146276
| Tanimoto metric | 0.7125 |
|---|---|
| Cosine metric | 0.8441 |
| Dice metric | 0.8321 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+645 more
