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DocumentationIdentifier: MM243596
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM243596 |
| SMILES |
COCC(F)(CO)C(C)O
|
| InChIKey |
CCIADORZZRXPMA-UHFFFAOYSA-N
|
| MW [Da] |
152.17
Automatically obtained from RDkit software. |
| LogP |
-0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM42137
Similarity: 0.7203
Similarity to MM42137
| Tanimoto metric | 0.7203 |
|---|---|
| Cosine metric | 0.8487 |
| Dice metric | 0.8374 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM28655
Similarity: 0.6186
Similarity to MM28655
| Tanimoto metric | 0.6186 |
|---|---|
| Cosine metric | 0.7865 |
| Dice metric | 0.7644 |
| MW: | 122.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM242975
Similarity: 0.6028
Similarity to MM242975
| Tanimoto metric | 0.6028 |
|---|---|
| Cosine metric | 0.7529 |
| Dice metric | 0.7522 |
| MW: | 152.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+341 more
