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DocumentationIdentifier: MM340219
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM340219 |
| SMILES |
C=CC(C=C)NCC(F)F
|
| InChIKey |
SRVYCGYWWALCIH-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
1.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM340011
Similarity: 0.6957
Similarity to MM340011
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8238 |
| Dice metric | 0.8205 |
| MW: | 153.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340009
Similarity: 0.6465
Similarity to MM340009
| Tanimoto metric | 0.6465 |
|---|---|
| Cosine metric | 0.7919 |
| Dice metric | 0.7853 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340352
Similarity: 0.6337
Similarity to MM340352
| Tanimoto metric | 0.6337 |
|---|---|
| Cosine metric | 0.7834 |
| Dice metric | 0.7758 |
| MW: | 145.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+199 more
