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DocumentationIdentifier: MM354750
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM354750 |
| SMILES |
C=CCCC(=O)C(F)=CC
|
| InChIKey |
HDBQVQVENRPBRU-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174860
Similarity: 0.8678
Similarity to MM174860
| Tanimoto metric | 0.8678 |
|---|---|
| Cosine metric | 0.9315 |
| Dice metric | 0.9292 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354659
Similarity: 0.8195
Similarity to MM354659
| Tanimoto metric | 0.8195 |
|---|---|
| Cosine metric | 0.9008 |
| Dice metric | 0.9008 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM296334
Similarity: 0.7279
Similarity to MM296334
| Tanimoto metric | 0.7279 |
|---|---|
| Cosine metric | 0.8435 |
| Dice metric | 0.8425 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+267 more
