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DocumentationIdentifier: MM227974
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM227974 |
| SMILES |
CC(=O)NCC(C)(C)CN
|
| InChIKey |
JRDDSVCKIHBGHK-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM73727
Similarity: 0.8333
Similarity to MM73727
| Tanimoto metric | 0.8333 |
|---|---|
| Cosine metric | 0.9129 |
| Dice metric | 0.9091 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM340484
Similarity: 0.8046
Similarity to MM340484
| Tanimoto metric | 0.8046 |
|---|---|
| Cosine metric | 0.8939 |
| Dice metric | 0.8917 |
| MW: | 145.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM93208
Similarity: 0.7609
Similarity to MM93208
| Tanimoto metric | 0.7609 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8642 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+437 more
