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DocumentationIdentifier: MM372319
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM372319 |
| SMILES |
CCOC=CCC(C)CN
|
| InChIKey |
DEIQHCJGGUMLFT-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.52
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM405639
Similarity: 0.7654
Similarity to MM405639
| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8673 |
| Dice metric | 0.8671 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM214704
Similarity: 0.7534
Similarity to MM214704
| Tanimoto metric | 0.7534 |
|---|---|
| Cosine metric | 0.868 |
| Dice metric | 0.8594 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM240290
Similarity: 0.7412
Similarity to MM240290
| Tanimoto metric | 0.7412 |
|---|---|
| Cosine metric | 0.8514 |
| Dice metric | 0.8514 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+673 more
