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DocumentationIdentifier: MM294234
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM294234 |
| SMILES |
CCCC(N)C(O)C=CF
|
| InChIKey |
ZOKSPDDOGIDYAS-UHFFFAOYSA-N
|
| MW [Da] |
147.19
Automatically obtained from RDkit software. |
| LogP |
0.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172066
Similarity: 0.754
Similarity to MM172066
| Tanimoto metric | 0.754 |
|---|---|
| Cosine metric | 0.8683 |
| Dice metric | 0.8597 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362403
Similarity: 0.669
Similarity to MM362403
| Tanimoto metric | 0.669 |
|---|---|
| Cosine metric | 0.8033 |
| Dice metric | 0.8017 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM362404
Similarity: 0.6643
Similarity to MM362404
| Tanimoto metric | 0.6643 |
|---|---|
| Cosine metric | 0.7997 |
| Dice metric | 0.7983 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+365 more
