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DocumentationIdentifier: MM360307
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM360307 |
| SMILES |
O=CNCC(F)=CCCF
|
| InChIKey |
HWSZGMZPVRUHPN-UHFFFAOYSA-N
|
| MW [Da] |
149.14
Automatically obtained from RDkit software. |
| LogP |
0.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM360385
Similarity: 0.7611
Similarity to MM360385
| Tanimoto metric | 0.7611 |
|---|---|
| Cosine metric | 0.8643 |
| Dice metric | 0.8643 |
| MW: | 143.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM84290
Similarity: 0.7203
Similarity to MM84290
| Tanimoto metric | 0.7203 |
|---|---|
| Cosine metric | 0.8375 |
| Dice metric | 0.8374 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM360387
Similarity: 0.7083
Similarity to MM360387
| Tanimoto metric | 0.7083 |
|---|---|
| Cosine metric | 0.8295 |
| Dice metric | 0.8293 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+225 more
