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DocumentationIdentifier: MM37994
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM37994 |
| SMILES |
O=CCCNC(C=O)C=O
|
| InChIKey |
YUZWXXCVSIBDGG-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM99682
Similarity: 0.7179
Similarity to MM99682
| Tanimoto metric | 0.7179 |
|---|---|
| Cosine metric | 0.8373 |
| Dice metric | 0.8358 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM404340
Similarity: 0.7089
Similarity to MM404340
| Tanimoto metric | 0.7089 |
|---|---|
| Cosine metric | 0.8315 |
| Dice metric | 0.8296 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM54404
Similarity: 0.6618
Similarity to MM54404
| Tanimoto metric | 0.6618 |
|---|---|
| Cosine metric | 0.8018 |
| Dice metric | 0.7965 |
| MW: | 129.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+165 more
