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DocumentationIdentifier: MM92449
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM92449 |
| SMILES |
CCNCCCC(=O)CO
|
| InChIKey |
FUKNINIZJNWRGW-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
-0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM287042
Similarity: 0.6957
Similarity to MM287042
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8222 |
| Dice metric | 0.8205 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316433
Similarity: 0.6549
Similarity to MM316433
| Tanimoto metric | 0.6549 |
|---|---|
| Cosine metric | 0.7965 |
| Dice metric | 0.7914 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM261861
Similarity: 0.6348
Similarity to MM261861
| Tanimoto metric | 0.6348 |
|---|---|
| Cosine metric | 0.782 |
| Dice metric | 0.7766 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+391 more
