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DocumentationIdentifier: MM135103
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM135103 |
| SMILES |
CC(O)CN(C)CCO
|
| InChIKey |
CRJALRGNJLMCAQ-UHFFFAOYSA-N
|
| MW [Da] |
133.19
Automatically obtained from RDkit software. |
| LogP |
-0.71
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM223093
Similarity: 0.9296
Similarity to MM223093
| Tanimoto metric | 0.9296 |
|---|---|
| Cosine metric | 0.9641 |
| Dice metric | 0.9635 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM56510
Similarity: 0.9167
Similarity to MM56510
| Tanimoto metric | 0.9167 |
|---|---|
| Cosine metric | 0.9574 |
| Dice metric | 0.9565 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM135102
Similarity: 0.8451
Similarity to MM135102
| Tanimoto metric | 0.8451 |
|---|---|
| Cosine metric | 0.9161 |
| Dice metric | 0.916 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+536 more
