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DocumentationIdentifier: MM376850
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376850 |
| SMILES |
C=COC(C#N)C(F)C#N
|
| InChIKey |
IEUDFKFXNBDTLS-UHFFFAOYSA-N
|
| MW [Da] |
140.12
Automatically obtained from RDkit software. |
| LogP |
0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM53256
Similarity: 0.7655
Similarity to MM53256
| Tanimoto metric | 0.7655 |
|---|---|
| Cosine metric | 0.8749 |
| Dice metric | 0.8672 |
| MW: | 128.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172200
Similarity: 0.7448
Similarity to MM172200
| Tanimoto metric | 0.7448 |
|---|---|
| Cosine metric | 0.863 |
| Dice metric | 0.8538 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376711
Similarity: 0.6437
Similarity to MM376711
| Tanimoto metric | 0.6437 |
|---|---|
| Cosine metric | 0.7833 |
| Dice metric | 0.7832 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.78 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+60 more
