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DocumentationIdentifier: MM378019
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378019 |
| SMILES |
N=CN(C=CC=O)CCF
|
| InChIKey |
ALTBAUGTBOQPGD-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
0.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM378263
Similarity: 0.65
Similarity to MM378263
| Tanimoto metric | 0.65 |
|---|---|
| Cosine metric | 0.7882 |
| Dice metric | 0.7879 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378410
Similarity: 0.6094
Similarity to MM378410
| Tanimoto metric | 0.6094 |
|---|---|
| Cosine metric | 0.7573 |
| Dice metric | 0.7573 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378015
Similarity: 0.6094
Similarity to MM378015
| Tanimoto metric | 0.6094 |
|---|---|
| Cosine metric | 0.7573 |
| Dice metric | 0.7573 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+209 more
