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DocumentationIdentifier: MM308652
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308652 |
| SMILES |
N#CCCC(F)(C=O)CO
|
| InChIKey |
UPBGBYGYERTGHC-UHFFFAOYSA-N
|
| MW [Da] |
145.13
Automatically obtained from RDkit software. |
| LogP |
0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM308399
Similarity: 0.6903
Similarity to MM308399
| Tanimoto metric | 0.6903 |
|---|---|
| Cosine metric | 0.8172 |
| Dice metric | 0.8168 |
| MW: | 150.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308650
Similarity: 0.6903
Similarity to MM308650
| Tanimoto metric | 0.6903 |
|---|---|
| Cosine metric | 0.8172 |
| Dice metric | 0.8168 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308902
Similarity: 0.6524
Similarity to MM308902
| Tanimoto metric | 0.6524 |
|---|---|
| Cosine metric | 0.7897 |
| Dice metric | 0.7897 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+86 more
