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DocumentationIdentifier: MM420904
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM420904 |
| SMILES |
C=CC=COC(C=C)=CF
|
| InChIKey |
USAKKBVOWSLMED-UHFFFAOYSA-N
|
| MW [Da] |
140.16
Automatically obtained from RDkit software. |
| LogP |
2.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM200420
Similarity: 0.8723
Similarity to MM200420
| Tanimoto metric | 0.8723 |
|---|---|
| Cosine metric | 0.934 |
| Dice metric | 0.9318 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM420379
Similarity: 0.783
Similarity to MM420379
| Tanimoto metric | 0.783 |
|---|---|
| Cosine metric | 0.8783 |
| Dice metric | 0.8783 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM420366
Similarity: 0.7593
Similarity to MM420366
| Tanimoto metric | 0.7593 |
|---|---|
| Cosine metric | 0.8632 |
| Dice metric | 0.8632 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+219 more
