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DocumentationIdentifier: MM102590
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM102590 |
| SMILES |
CN(C=O)C(C)(C)C
|
| InChIKey |
GZKMWSAXNHPVJH-UHFFFAOYSA-N
|
| MW [Da] |
115.18
Automatically obtained from RDkit software. |
| LogP |
0.87
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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MM24745
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Similarity to MM24745
| Tanimoto metric | 0.7551 |
|---|---|
| Cosine metric | 0.869 |
| Dice metric | 0.8605 |
| MW: | 101.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM220759
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| Tanimoto metric | 0.6901 |
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| Cosine metric | 0.8307 |
| Dice metric | 0.8167 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM63816
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Similarity to MM63816
| Tanimoto metric | 0.6282 |
|---|---|
| Cosine metric | 0.7926 |
| Dice metric | 0.7717 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+297 more
