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DocumentationIdentifier: MM291358
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291358 |
| SMILES |
C#CCOCC(F)CCC
|
| InChIKey |
SUAOGQJZTUDCPN-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.77
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM155681
Similarity: 0.8
Similarity to MM155681
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355360
Similarity: 0.72
Similarity to MM355360
| Tanimoto metric | 0.72 |
|---|---|
| Cosine metric | 0.8381 |
| Dice metric | 0.8372 |
| MW: | 150.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291159
Similarity: 0.6923
Similarity to MM291159
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8184 |
| Dice metric | 0.8182 |
| MW: | 150.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+407 more
