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DocumentationIdentifier: MM69033
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM69033 |
| SMILES |
C=CCC(N)C(C)OC=O
|
| InChIKey |
LZGXXGPNGQLHDB-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.45
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM292674
Similarity: 0.6622
Similarity to MM292674
| Tanimoto metric | 0.6622 |
|---|---|
| Cosine metric | 0.797 |
| Dice metric | 0.7967 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM296709
Similarity: 0.6364
Similarity to MM296709
| Tanimoto metric | 0.6364 |
|---|---|
| Cosine metric | 0.7778 |
| Dice metric | 0.7778 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM233184
Similarity: 0.5976
Similarity to MM233184
| Tanimoto metric | 0.5976 |
|---|---|
| Cosine metric | 0.7486 |
| Dice metric | 0.7481 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+76 more
