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DocumentationIdentifier: MM407943
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM407943 |
| SMILES |
CCOC(=O)C(CC)CF
|
| InChIKey |
IPGOKXGHSMNKPZ-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197209
Similarity: 0.8168
Similarity to MM197209
| Tanimoto metric | 0.8168 |
|---|---|
| Cosine metric | 0.9038 |
| Dice metric | 0.8992 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM377358
Similarity: 0.673
Similarity to MM377358
| Tanimoto metric | 0.673 |
|---|---|
| Cosine metric | 0.8046 |
| Dice metric | 0.8045 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172994
Similarity: 0.6718
Similarity to MM172994
| Tanimoto metric | 0.6718 |
|---|---|
| Cosine metric | 0.8196 |
| Dice metric | 0.8037 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+223 more
