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DocumentationIdentifier: MM348228
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348228 |
| SMILES |
NCC(O)C(O)C(N)CF
|
| InChIKey |
DTHWNUOQNWLIDT-UHFFFAOYSA-N
|
| MW [Da] |
152.17
Automatically obtained from RDkit software. |
| LogP |
-2.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171784
Similarity: 0.6957
Similarity to MM171784
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8341 |
| Dice metric | 0.8205 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM141536
Similarity: 0.6667
Similarity to MM141536
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159946
Similarity: 0.6594
Similarity to MM159946
| Tanimoto metric | 0.6594 |
|---|---|
| Cosine metric | 0.812 |
| Dice metric | 0.7948 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+243 more
