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DocumentationIdentifier: MM84883
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM84883 |
| SMILES |
C=CCNC(=O)C(C)OC
|
| InChIKey |
BUVVEPSQPCMODN-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.32
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM47964
Similarity: 0.7717
Similarity to MM47964
| Tanimoto metric | 0.7717 |
|---|---|
| Cosine metric | 0.8784 |
| Dice metric | 0.8711 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM84853
Similarity: 0.7535
Similarity to MM84853
| Tanimoto metric | 0.7535 |
|---|---|
| Cosine metric | 0.8596 |
| Dice metric | 0.8594 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350203
Similarity: 0.7535
Similarity to MM350203
| Tanimoto metric | 0.7535 |
|---|---|
| Cosine metric | 0.8596 |
| Dice metric | 0.8594 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+375 more
