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DocumentationIdentifier: MM223602
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM223602 |
| SMILES |
CCC(O)C(N)C(C)(C)C
|
| InChIKey |
FECMWWXKTICOSN-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM159925
Similarity: 0.8131
Similarity to MM159925
| Tanimoto metric | 0.8131 |
|---|---|
| Cosine metric | 0.9017 |
| Dice metric | 0.8969 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM129809
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| Tanimoto metric | 0.7757 |
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| Cosine metric | 0.8807 |
| Dice metric | 0.8737 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.74 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM80297
Similarity: 0.635
Similarity to MM80297
| Tanimoto metric | 0.635 |
|---|---|
| Cosine metric | 0.7776 |
| Dice metric | 0.7768 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+419 more
