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DocumentationIdentifier: MM265650
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265650 |
| SMILES |
C#CCC(=O)C1C(C)N1C
|
| InChIKey |
VLDWFULDMYDORL-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM454109
Similarity: 0.8228
Similarity to MM454109
| Tanimoto metric | 0.8228 |
|---|---|
| Cosine metric | 0.9071 |
| Dice metric | 0.9028 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265989
Similarity: 0.7126
Similarity to MM265989
| Tanimoto metric | 0.7126 |
|---|---|
| Cosine metric | 0.8355 |
| Dice metric | 0.8322 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM396422
Similarity: 0.6989
Similarity to MM396422
| Tanimoto metric | 0.6989 |
|---|---|
| Cosine metric | 0.8228 |
| Dice metric | 0.8228 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+94 more
