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DocumentationIdentifier: MM287364
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM287364 |
| SMILES |
C=C(C)CCNCC=CC
|
| InChIKey |
QGJFBOMDLZDHBK-UHFFFAOYSA-N
|
| MW [Da] |
139.24
Automatically obtained from RDkit software. |
| LogP |
2.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM152766
Similarity: 0.8676
Similarity to MM152766
| Tanimoto metric | 0.8676 |
|---|---|
| Cosine metric | 0.9315 |
| Dice metric | 0.9291 |
| MW: | 125.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM80627
Similarity: 0.7763
Similarity to MM80627
| Tanimoto metric | 0.7763 |
|---|---|
| Cosine metric | 0.8741 |
| Dice metric | 0.8741 |
| MW: | 139.24 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM371480
Similarity: 0.7683
Similarity to MM371480
| Tanimoto metric | 0.7683 |
|---|---|
| Cosine metric | 0.8706 |
| Dice metric | 0.869 |
| MW: | 139.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+667 more
