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DocumentationIdentifier: MM279937
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM279937 |
| SMILES |
C=CC=CCC(C)NC=N
|
| InChIKey |
RAMGEPFLEQQLIS-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156762
Similarity: 0.8409
Similarity to MM156762
| Tanimoto metric | 0.8409 |
|---|---|
| Cosine metric | 0.917 |
| Dice metric | 0.9136 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279877
Similarity: 0.7789
Similarity to MM279877
| Tanimoto metric | 0.7789 |
|---|---|
| Cosine metric | 0.8765 |
| Dice metric | 0.8757 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279878
Similarity: 0.7551
Similarity to MM279878
| Tanimoto metric | 0.7551 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8605 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+251 more
