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DocumentationIdentifier: MM37114
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM37114 |
| SMILES |
C=CCNC(C=O)C(C)=O
|
| InChIKey |
STRXETGIBGRPOI-UHFFFAOYSA-N
|
| MW [Da] |
141.17
Automatically obtained from RDkit software. |
| LogP |
-0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM102337
Similarity: 0.7521
Similarity to MM102337
| Tanimoto metric | 0.7521 |
|---|---|
| Cosine metric | 0.8594 |
| Dice metric | 0.8585 |
| MW: | 143.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM393491
Similarity: 0.6797
Similarity to MM393491
| Tanimoto metric | 0.6797 |
|---|---|
| Cosine metric | 0.8093 |
| Dice metric | 0.8093 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400838
Similarity: 0.6197
Similarity to MM400838
| Tanimoto metric | 0.6197 |
|---|---|
| Cosine metric | 0.7671 |
| Dice metric | 0.7652 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+11 more
