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DocumentationIdentifier: MM212080
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM212080 |
| SMILES |
CC(CN)N1C(C)C1C
|
| InChIKey |
OBUDSGQRBDSADA-UHFFFAOYSA-N
|
| MW [Da] |
128.22
Automatically obtained from RDkit software. |
| LogP |
0.43
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 | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.8987 |
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| PI: | 2
Total passive interactions
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| LogP: | 0.82 |
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MM210623
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Similarity to MM210623
| Tanimoto metric | 0.748 |
|---|---|
| Cosine metric | 0.8571 |
| Dice metric | 0.8559 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+281 more
