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DocumentationIdentifier: MM63885
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM63885 |
| SMILES |
C#CCOC(C#C)CNC
|
| InChIKey |
MWDAMERHMBJBFD-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
-0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM272184
Similarity: 0.7542
Similarity to MM272184
| Tanimoto metric | 0.7542 |
|---|---|
| Cosine metric | 0.8604 |
| Dice metric | 0.8599 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM62070
Similarity: 0.74
Similarity to MM62070
| Tanimoto metric | 0.74 |
|---|---|
| Cosine metric | 0.8602 |
| Dice metric | 0.8506 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM63884
Similarity: 0.7333
Similarity to MM63884
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8468 |
| Dice metric | 0.8462 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+291 more
