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DocumentationIdentifier: MM364877
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM364877 |
| SMILES |
C=CC(O)C=CCC=CC
|
| InChIKey |
JNDAFMZOCFLGSM-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM338387
Similarity: 0.9333
Similarity to MM338387
| Tanimoto metric | 0.9333 |
|---|---|
| Cosine metric | 0.9655 |
| Dice metric | 0.9655 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM169678
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| Tanimoto metric | 0.8966 |
|---|---|
| Cosine metric | 0.9469 |
| Dice metric | 0.9455 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM323032
Similarity: 0.8333
Similarity to MM323032
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9104 |
| Dice metric | 0.9091 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+410 more
