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DocumentationIdentifier: MM224143
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM224143 |
| SMILES |
CC(C)(C)OC(CN)CN
|
| InChIKey |
LBIKOBDCAAXMNP-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130030
Similarity: 0.873
Similarity to MM130030
| Tanimoto metric | 0.873 |
|---|---|
| Cosine metric | 0.9344 |
| Dice metric | 0.9322 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM228986
Similarity: 0.7922
Similarity to MM228986
| Tanimoto metric | 0.7922 |
|---|---|
| Cosine metric | 0.8874 |
| Dice metric | 0.8841 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM325981
Similarity: 0.7761
Similarity to MM325981
| Tanimoto metric | 0.7761 |
|---|---|
| Cosine metric | 0.8755 |
| Dice metric | 0.8739 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
