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DocumentationIdentifier: MM283089
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM283089 |
| SMILES |
CC#CC#CC(C)NC=N
|
| InChIKey |
QJIDZDROIWWRME-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM83915
Similarity: 0.8916
Similarity to MM83915
| Tanimoto metric | 0.8916 |
|---|---|
| Cosine metric | 0.9442 |
| Dice metric | 0.9427 |
| MW: | 120.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM380239
Similarity: 0.7551
Similarity to MM380239
| Tanimoto metric | 0.7551 |
|---|---|
| Cosine metric | 0.861 |
| Dice metric | 0.8605 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM458855
Similarity: 0.7176
Similarity to MM458855
| Tanimoto metric | 0.7176 |
|---|---|
| Cosine metric | 0.8436 |
| Dice metric | 0.8356 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+162 more
