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DocumentationIdentifier: MM261319
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261319 |
| SMILES |
CCCN(C)CC(C)OC
|
| InChIKey |
WEEOBZAYCPVUPD-UHFFFAOYSA-N
|
| MW [Da] |
145.25
Automatically obtained from RDkit software. |
| LogP |
1.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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Similarity to MM141609
| Tanimoto metric | 0.8778 |
|---|---|
| Cosine metric | 0.9369 |
| Dice metric | 0.9349 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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|---|---|
| Cosine metric | 0.9171 |
| Dice metric | 0.9171 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.05 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM326078
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Similarity to MM326078
| Tanimoto metric | 0.8229 |
|---|---|
| Cosine metric | 0.9032 |
| Dice metric | 0.9029 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+354 more
