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DocumentationIdentifier: MM376135
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376135 |
| SMILES |
C#CCC#CCC(=O)NC
|
| InChIKey |
CDVHBIJGQRJDDB-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
0.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169231
Similarity: 0.8795
Similarity to MM169231
| Tanimoto metric | 0.8795 |
|---|---|
| Cosine metric | 0.9378 |
| Dice metric | 0.9359 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376025
Similarity: 0.8488
Similarity to MM376025
| Tanimoto metric | 0.8488 |
|---|---|
| Cosine metric | 0.9191 |
| Dice metric | 0.9182 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376023
Similarity: 0.7849
Similarity to MM376023
| Tanimoto metric | 0.7849 |
|---|---|
| Cosine metric | 0.8795 |
| Dice metric | 0.8795 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.93 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+301 more
