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DocumentationIdentifier: MM65024
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM65024 |
| SMILES |
C=C(COC)NC(=O)CC
|
| InChIKey |
OXAFPKGBDATPJQ-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM263121
Similarity: 0.7114
Similarity to MM263121
| Tanimoto metric | 0.7114 |
|---|---|
| Cosine metric | 0.8314 |
| Dice metric | 0.8314 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263122
Similarity: 0.702
Similarity to MM263122
| Tanimoto metric | 0.702 |
|---|---|
| Cosine metric | 0.8249 |
| Dice metric | 0.8249 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263396
Similarity: 0.6731
Similarity to MM263396
| Tanimoto metric | 0.6731 |
|---|---|
| Cosine metric | 0.8047 |
| Dice metric | 0.8046 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+539 more
