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DocumentationIdentifier: MM377314
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM377314 |
| SMILES |
C=C(C)C(C)=CC(C)(C)O
|
| InChIKey |
FFWYGXOEMPANJU-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM377328
Similarity: 0.7953
Similarity to MM377328
| Tanimoto metric | 0.7953 |
|---|---|
| Cosine metric | 0.8865 |
| Dice metric | 0.886 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM342379
Similarity: 0.7712
Similarity to MM342379
| Tanimoto metric | 0.7712 |
|---|---|
| Cosine metric | 0.8782 |
| Dice metric | 0.8708 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM383157
Similarity: 0.6695
Similarity to MM383157
| Tanimoto metric | 0.6695 |
|---|---|
| Cosine metric | 0.8182 |
| Dice metric | 0.802 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+359 more
