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DocumentationIdentifier: MM349570
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM349570 |
| SMILES |
C=C(CN)C(C)N(C)C=O
|
| InChIKey |
VYLGRFJVFIHUEC-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
-0.02
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 | 0.7664 |
|---|---|
| Cosine metric | 0.8755 |
| Dice metric | 0.8678 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | -0.36 |
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Total active interactions
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| Tanimoto metric | 0.6732 |
|---|---|
| Cosine metric | 0.8067 |
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| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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