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DocumentationIdentifier: MM352445
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM352445 |
| SMILES |
C=CCOC(=C)C(=C)C=C
|
| InChIKey |
YUAQOKWPMQYBDD-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173824
Similarity: 0.9065
Similarity to MM173824
| Tanimoto metric | 0.9065 |
|---|---|
| Cosine metric | 0.9521 |
| Dice metric | 0.951 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM319982
Similarity: 0.7241
Similarity to MM319982
| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.8421 |
| Dice metric | 0.84 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173866
Similarity: 0.7179
Similarity to MM173866
| Tanimoto metric | 0.7179 |
|---|---|
| Cosine metric | 0.8376 |
| Dice metric | 0.8358 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+51 more
