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DocumentationIdentifier: MM221557
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221557 |
| SMILES |
C=C(CC(=N)N)C(C)(C)C
|
| InChIKey |
IHPPTRISWRCRNI-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.91
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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MM269264
Similarity: 0.6797
Similarity to MM269264
| Tanimoto metric | 0.6797 |
|---|---|
| Cosine metric | 0.81 |
| Dice metric | 0.8093 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM269263
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| Tanimoto metric | 0.6641 |
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| Cosine metric | 0.7994 |
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| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM275575
Similarity: 0.6493
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| Tanimoto metric | 0.6493 |
|---|---|
| Cosine metric | 0.7892 |
| Dice metric | 0.7873 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 1.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+165 more
