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DocumentationIdentifier: MM215633
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM215633 |
| SMILES |
C=CC=CC=COC=C
|
| InChIKey |
HSLACCMZTJCPHF-UHFFFAOYSA-N
|
| MW [Da] |
122.17
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
MM457435
Similarity: 0.9574
Similarity to MM457435
| Tanimoto metric | 0.9574 |
|---|---|
| Cosine metric | 0.9785 |
| Dice metric | 0.9783 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM126749
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| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM453366
Similarity: 0.8511
Similarity to MM453366
| Tanimoto metric | 0.8511 |
|---|---|
| Cosine metric | 0.9201 |
| Dice metric | 0.9195 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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