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DocumentationIdentifier: MM234111
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM234111 |
| SMILES |
CC=CC(C)(O)CNC=O
|
| InChIKey |
VCSLKXNXDYXGIC-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138422
Similarity: 0.7769
Similarity to MM138422
| Tanimoto metric | 0.7769 |
|---|---|
| Cosine metric | 0.8814 |
| Dice metric | 0.8744 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309409
Similarity: 0.6963
Similarity to MM309409
| Tanimoto metric | 0.6963 |
|---|---|
| Cosine metric | 0.8223 |
| Dice metric | 0.821 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM83617
Similarity: 0.6231
Similarity to MM83617
| Tanimoto metric | 0.6231 |
|---|---|
| Cosine metric | 0.7762 |
| Dice metric | 0.7678 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
