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DocumentationIdentifier: MM375898
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM375898 |
| SMILES |
N#CCC(CO)C(F)CO
|
| InChIKey |
PKASKTJITRUQNV-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM94037
Similarity: 0.6408
Similarity to MM94037
| Tanimoto metric | 0.6408 |
|---|---|
| Cosine metric | 0.7817 |
| Dice metric | 0.7811 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM375902
Similarity: 0.6053
Similarity to MM375902
| Tanimoto metric | 0.6053 |
|---|---|
| Cosine metric | 0.7541 |
| Dice metric | 0.7541 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348332
Similarity: 0.6026
Similarity to MM348332
| Tanimoto metric | 0.6026 |
|---|---|
| Cosine metric | 0.7521 |
| Dice metric | 0.7521 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+182 more
