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DocumentationIdentifier: MM293807
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293807 |
| SMILES |
C#CCC(=N)N(C)CC#C
|
| InChIKey |
ZORXIJAGGVTMBS-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
0.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM408468
Similarity: 0.7627
Similarity to MM408468
| Tanimoto metric | 0.7627 |
|---|---|
| Cosine metric | 0.8668 |
| Dice metric | 0.8654 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354356
Similarity: 0.7087
Similarity to MM354356
| Tanimoto metric | 0.7087 |
|---|---|
| Cosine metric | 0.8296 |
| Dice metric | 0.8295 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM74373
Similarity: 0.6861
Similarity to MM74373
| Tanimoto metric | 0.6861 |
|---|---|
| Cosine metric | 0.8148 |
| Dice metric | 0.8139 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+356 more
