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DocumentationIdentifier: MM310000
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM310000 |
| SMILES |
C=C(CO)C(=C)CC(C)O
|
| InChIKey |
HQEHUEHAXPBPSS-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.86
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM381268
Similarity: 0.8091
Similarity to MM381268
| Tanimoto metric | 0.8091 |
|---|---|
| Cosine metric | 0.8995 |
| Dice metric | 0.8945 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM343614
Similarity: 0.7823
Similarity to MM343614
| Tanimoto metric | 0.7823 |
|---|---|
| Cosine metric | 0.8778 |
| Dice metric | 0.8778 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM246584
Similarity: 0.7231
Similarity to MM246584
| Tanimoto metric | 0.7231 |
|---|---|
| Cosine metric | 0.8394 |
| Dice metric | 0.8393 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+339 more
