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DocumentationIdentifier: MM293817
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293817 |
| SMILES |
C=C(CCF)C(=C)CCF
|
| InChIKey |
YLEGQAFTCZAUHH-UHFFFAOYSA-N
|
| MW [Da] |
146.18
Automatically obtained from RDkit software. |
| LogP |
2.82
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM108452
Similarity: 0.8382
Similarity to MM108452
| Tanimoto metric | 0.8382 |
|---|---|
| Cosine metric | 0.9156 |
| Dice metric | 0.912 |
| MW: | 114.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293815
Similarity: 0.6875
Similarity to MM293815
| Tanimoto metric | 0.6875 |
|---|---|
| Cosine metric | 0.8255 |
| Dice metric | 0.8148 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM293914
Similarity: 0.6735
Similarity to MM293914
| Tanimoto metric | 0.6735 |
|---|---|
| Cosine metric | 0.8169 |
| Dice metric | 0.8049 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+277 more
