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DocumentationIdentifier: MM414324
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM414324 |
| SMILES |
CCNC(C)C(=CF)OC
|
| InChIKey |
JCAKHDHOEPAZKI-UHFFFAOYSA-N
|
| MW [Da] |
147.19
Automatically obtained from RDkit software. |
| LogP |
1.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM28482
Similarity: 0.6433
Similarity to MM28482
| Tanimoto metric | 0.6433 |
|---|---|
| Cosine metric | 0.7883 |
| Dice metric | 0.7829 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199785
Similarity: 0.6042
Similarity to MM199785
| Tanimoto metric | 0.6042 |
|---|---|
| Cosine metric | 0.7773 |
| Dice metric | 0.7532 |
| MW: | 133.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM341823
Similarity: 0.6039
Similarity to MM341823
| Tanimoto metric | 0.6039 |
|---|---|
| Cosine metric | 0.7636 |
| Dice metric | 0.753 |
| MW: | 147.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+297 more
