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DocumentationIdentifier: MM58633
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM58633 |
| SMILES |
C=C(F)C(O)C(=C)CN
|
| InChIKey |
UYIVHRHTFWDBFL-UHFFFAOYSA-N
|
| MW [Da] |
131.15
Automatically obtained from RDkit software. |
| LogP |
0.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM58704
Similarity: 0.5606
Similarity to MM58704
| Tanimoto metric | 0.5606 |
|---|---|
| Cosine metric | 0.7487 |
| Dice metric | 0.7184 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160508
Similarity: 0.5422
Similarity to MM160508
| Tanimoto metric | 0.5422 |
|---|---|
| Cosine metric | 0.7035 |
| Dice metric | 0.7031 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104533
Similarity: 0.5379
Similarity to MM104533
| Tanimoto metric | 0.5379 |
|---|---|
| Cosine metric | 0.7334 |
| Dice metric | 0.6995 |
| MW: | 115.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+105 more
