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DocumentationIdentifier: MM246246
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246246 |
| SMILES |
C=C(CN)CC(=C)C(F)F
|
| InChIKey |
KMUXQCKSXQWYHC-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
1.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142521
Similarity: 0.7642
Similarity to MM142521
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8742 |
| Dice metric | 0.8663 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246248
Similarity: 0.6937
Similarity to MM246248
| Tanimoto metric | 0.6937 |
|---|---|
| Cosine metric | 0.8259 |
| Dice metric | 0.8191 |
| MW: | 150.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263030
Similarity: 0.6136
Similarity to MM263030
| Tanimoto metric | 0.6136 |
|---|---|
| Cosine metric | 0.7606 |
| Dice metric | 0.7606 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+360 more
