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DocumentationIdentifier: MM234397
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM234397 |
| SMILES |
CC(F)(C#CC#N)CCF
|
| InChIKey |
OURTXNSKKFCHMU-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
1.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM139033
Similarity: 0.7909
Similarity to MM139033
| Tanimoto metric | 0.7909 |
|---|---|
| Cosine metric | 0.8893 |
| Dice metric | 0.8832 |
| MW: | 125.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234381
Similarity: 0.7107
Similarity to MM234381
| Tanimoto metric | 0.7107 |
|---|---|
| Cosine metric | 0.8326 |
| Dice metric | 0.8309 |
| MW: | 150.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234395
Similarity: 0.6642
Similarity to MM234395
| Tanimoto metric | 0.6642 |
|---|---|
| Cosine metric | 0.7983 |
| Dice metric | 0.7982 |
| MW: | 139.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+286 more
