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DocumentationIdentifier: MM160352
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM160352 |
| SMILES |
C=C(CN)C(O)C(C)N
|
| InChIKey |
AVTCMYIRIQPRPO-UHFFFAOYSA-N
|
| MW [Da] |
130.19
Automatically obtained from RDkit software. |
| LogP |
-0.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM297214
Similarity: 0.7748
Similarity to MM297214
| Tanimoto metric | 0.7748 |
|---|---|
| Cosine metric | 0.8802 |
| Dice metric | 0.8731 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348790
Similarity: 0.7697
Similarity to MM348790
| Tanimoto metric | 0.7697 |
|---|---|
| Cosine metric | 0.8773 |
| Dice metric | 0.8699 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253963
Similarity: 0.7452
Similarity to MM253963
| Tanimoto metric | 0.7452 |
|---|---|
| Cosine metric | 0.8633 |
| Dice metric | 0.854 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+564 more
