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DocumentationIdentifier: MM404670
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM404670 |
| SMILES |
CN=CNCC(CO)NC
|
| InChIKey |
MKMUPEKMJYYOAI-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-1.19
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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MM198661
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| Tanimoto metric | 0.8404 |
|---|---|
| Cosine metric | 0.9167 |
| Dice metric | 0.9133 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Tanimoto metric | 0.7872 |
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| Cosine metric | 0.8873 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.45 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM386439
Similarity: 0.7453
Similarity to MM386439
| Tanimoto metric | 0.7453 |
|---|---|
| Cosine metric | 0.8542 |
| Dice metric | 0.8541 |
| MW: | 144.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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