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DocumentationIdentifier: MM59641
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM59641 |
| SMILES |
CC(=O)CC(F)CCCO
|
| InChIKey |
ZKXUXSZIOOYUEQ-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM64748
Similarity: 0.7431
Similarity to MM64748
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8543 |
| Dice metric | 0.8526 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM57425
Similarity: 0.6923
Similarity to MM57425
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8224 |
| Dice metric | 0.8182 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM96438
Similarity: 0.6697
Similarity to MM96438
| Tanimoto metric | 0.6697 |
|---|---|
| Cosine metric | 0.8024 |
| Dice metric | 0.8022 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+407 more
