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DocumentationIdentifier: MM90751
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM90751 |
| SMILES |
CC(CCCCN)OC=O
|
| InChIKey |
HZSJQSSISBGUDK-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
0.68
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250551
Similarity: 0.7238
Similarity to MM250551
| Tanimoto metric | 0.7238 |
|---|---|
| Cosine metric | 0.842 |
| Dice metric | 0.8398 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM386283
Similarity: 0.7222
Similarity to MM386283
| Tanimoto metric | 0.7222 |
|---|---|
| Cosine metric | 0.8427 |
| Dice metric | 0.8387 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250552
Similarity: 0.6804
Similarity to MM250552
| Tanimoto metric | 0.6804 |
|---|---|
| Cosine metric | 0.8102 |
| Dice metric | 0.8098 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+377 more
