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DocumentationIdentifier: MM230875
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM230875 |
| SMILES |
CC(C)(CN)OC1(C)CC1
|
| InChIKey |
IBSJTKFQVGTUND-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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| Tanimoto metric | 0.9065 |
|---|---|
| Cosine metric | 0.9521 |
| Dice metric | 0.951 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM324350
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| Tanimoto metric | 0.8509 |
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| Cosine metric | 0.9195 |
| Dice metric | 0.9194 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM340730
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Similarity to MM340730
| Tanimoto metric | 0.8468 |
|---|---|
| Cosine metric | 0.919 |
| Dice metric | 0.917 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+413 more
