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DocumentationIdentifier: MM294380
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM294380 |
| SMILES |
C=CCN(C)C(C)C=CC
|
| InChIKey |
ZQLGPBYRYPGCBN-UHFFFAOYSA-N
|
| MW [Da] |
139.24
Automatically obtained from RDkit software. |
| LogP |
2.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174009
Similarity: 0.869
Similarity to MM174009
| Tanimoto metric | 0.869 |
|---|---|
| Cosine metric | 0.9322 |
| Dice metric | 0.9299 |
| MW: | 127.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352895
Similarity: 0.8605
Similarity to MM352895
| Tanimoto metric | 0.8605 |
|---|---|
| Cosine metric | 0.9262 |
| Dice metric | 0.925 |
| MW: | 139.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355255
Similarity: 0.7526
Similarity to MM355255
| Tanimoto metric | 0.7526 |
|---|---|
| Cosine metric | 0.8589 |
| Dice metric | 0.8588 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+548 more
