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DocumentationIdentifier: MM325680
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM325680 |
| SMILES |
NCC(CO)CC(O)CO
|
| InChIKey |
HIINMFCPEHVIRC-UHFFFAOYSA-N
|
| MW [Da] |
149.19
Automatically obtained from RDkit software. |
| LogP |
-1.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141508
Similarity: 0.7379
Similarity to MM141508
| Tanimoto metric | 0.7379 |
|---|---|
| Cosine metric | 0.859 |
| Dice metric | 0.8492 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM225971
Similarity: 0.6587
Similarity to MM225971
| Tanimoto metric | 0.6587 |
|---|---|
| Cosine metric | 0.7943 |
| Dice metric | 0.7943 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM307687
Similarity: 0.6565
Similarity to MM307687
| Tanimoto metric | 0.6565 |
|---|---|
| Cosine metric | 0.7936 |
| Dice metric | 0.7926 |
| MW: | 149.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+335 more
