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DocumentationIdentifier: MM251927
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM251927 |
| SMILES |
C=CC=C(C)CCC(=C)C
|
| InChIKey |
AMRRLPCUDYHUEZ-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.48
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM158883
Similarity: 0.8571
Similarity to MM158883
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM283749
Similarity: 0.8333
Similarity to MM283749
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9108 |
| Dice metric | 0.9091 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM371945
Similarity: 0.8056
Similarity to MM371945
| Tanimoto metric | 0.8056 |
|---|---|
| Cosine metric | 0.895 |
| Dice metric | 0.8923 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+557 more
