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DocumentationIdentifier: MM232114
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM232114 |
| SMILES |
CC#CC(OC)C(C)(F)F
|
| InChIKey |
GUDFDEKZRPDPSZ-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
1.68
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM131394
Similarity: 0.7785
Similarity to MM131394
| Tanimoto metric | 0.7785 |
|---|---|
| Cosine metric | 0.8823 |
| Dice metric | 0.8755 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132229
Similarity: 0.698
Similarity to MM132229
| Tanimoto metric | 0.698 |
|---|---|
| Cosine metric | 0.8355 |
| Dice metric | 0.8221 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM47352
Similarity: 0.6416
Similarity to MM47352
| Tanimoto metric | 0.6416 |
|---|---|
| Cosine metric | 0.7826 |
| Dice metric | 0.7817 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+259 more
