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DocumentationIdentifier: MM62664
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM62664 |
| SMILES |
C=CC(O)C(=C)C(C)NC
|
| InChIKey |
CQTVQASFSTVJMG-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
0.7
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM62079
Similarity: 0.7669
Similarity to MM62079
| Tanimoto metric | 0.7669 |
|---|---|
| Cosine metric | 0.8757 |
| Dice metric | 0.8681 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160861
Similarity: 0.7178
Similarity to MM160861
| Tanimoto metric | 0.7178 |
|---|---|
| Cosine metric | 0.8472 |
| Dice metric | 0.8357 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM60845
Similarity: 0.6196
Similarity to MM60845
| Tanimoto metric | 0.6196 |
|---|---|
| Cosine metric | 0.7872 |
| Dice metric | 0.7652 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+150 more
