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DocumentationIdentifier: MM57425
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM57425 |
| SMILES |
CC(=O)CC(F)CC(C)O
|
| InChIKey |
PSDTYWWOSPHZJS-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM261368
Similarity: 0.7154
Similarity to MM261368
| Tanimoto metric | 0.7154 |
|---|---|
| Cosine metric | 0.8346 |
| Dice metric | 0.8341 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM59641
Similarity: 0.6923
Similarity to MM59641
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8224 |
| Dice metric | 0.8182 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261371
Similarity: 0.6515
Similarity to MM261371
| Tanimoto metric | 0.6515 |
|---|---|
| Cosine metric | 0.789 |
| Dice metric | 0.789 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+392 more
