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DocumentationIdentifier: MM249423
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM249423 |
| SMILES |
CC(C#N)N1C(C)C1(C)C
|
| InChIKey |
SRRLEUMWTIPLJB-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.38
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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MM155489
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| Tanimoto metric | 0.8323 |
|---|---|
| Cosine metric | 0.9123 |
| Dice metric | 0.9085 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.99 |
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| Tanimoto metric | 0.7212 |
|---|---|
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| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.5 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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+238 more
