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DocumentationIdentifier: MM405635
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM405635 |
| SMILES |
CCC(CN)CC=COC
|
| InChIKey |
GXXLQOPUGDZYML-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: 0.7126
Similarity to MM405639
| Tanimoto metric | 0.7126 |
|---|---|
| Cosine metric | 0.8337 |
| Dice metric | 0.8322 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372319
Similarity: 0.6889
Similarity to MM372319
| Tanimoto metric | 0.6889 |
|---|---|
| Cosine metric | 0.8164 |
| Dice metric | 0.8158 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279708
Similarity: 0.6813
Similarity to MM279708
| Tanimoto metric | 0.6813 |
|---|---|
| Cosine metric | 0.8109 |
| Dice metric | 0.8105 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+511 more
