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DocumentationIdentifier: MM374560
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM374560 |
| SMILES |
C=COCCCC1(C)CC1
|
| InChIKey |
APNVUVZYBQXKNA-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM176096
Similarity: 0.8506
Similarity to MM176096
| Tanimoto metric | 0.8506 |
|---|---|
| Cosine metric | 0.9223 |
| Dice metric | 0.9193 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM374500
Similarity: 0.7789
Similarity to MM374500
| Tanimoto metric | 0.7789 |
|---|---|
| Cosine metric | 0.8761 |
| Dice metric | 0.8757 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM425061
Similarity: 0.7789
Similarity to MM425061
| Tanimoto metric | 0.7789 |
|---|---|
| Cosine metric | 0.8761 |
| Dice metric | 0.8757 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+437 more
