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DocumentationIdentifier: MM287127
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM287127 |
| SMILES |
CC(=O)OCCNCCO
|
| InChIKey |
RMOPCJOZHHOQFT-UHFFFAOYSA-N
|
| MW [Da] |
147.17
Automatically obtained from RDkit software. |
| LogP |
-0.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM66179
Similarity: 0.9429
Similarity to MM66179
| Tanimoto metric | 0.9429 |
|---|---|
| Cosine metric | 0.971 |
| Dice metric | 0.9706 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM235699
Similarity: 0.8148
Similarity to MM235699
| Tanimoto metric | 0.8148 |
|---|---|
| Cosine metric | 0.899 |
| Dice metric | 0.898 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM287263
Similarity: 0.8049
Similarity to MM287263
| Tanimoto metric | 0.8049 |
|---|---|
| Cosine metric | 0.8932 |
| Dice metric | 0.8919 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+279 more
