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DocumentationIdentifier: MM274243
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM274243 |
| SMILES |
C#CC=C(C=C(C)C)OC
|
| InChIKey |
YBUOQOPWEOROSA-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM150758
Similarity: 0.767
Similarity to MM150758
| Tanimoto metric | 0.767 |
|---|---|
| Cosine metric | 0.8758 |
| Dice metric | 0.8681 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM336419
Similarity: 0.7302
Similarity to MM336419
| Tanimoto metric | 0.7302 |
|---|---|
| Cosine metric | 0.8453 |
| Dice metric | 0.844 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM397750
Similarity: 0.6967
Similarity to MM397750
| Tanimoto metric | 0.6967 |
|---|---|
| Cosine metric | 0.8213 |
| Dice metric | 0.8213 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+257 more
