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DocumentationIdentifier: MM317500
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM317500 |
| SMILES |
C=CC(F)CNC(=N)CC
|
| InChIKey |
SNPKOCZCQGPZJD-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250968
Similarity: 0.8
Similarity to MM250968
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8895 |
| Dice metric | 0.8889 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM318017
Similarity: 0.6815
Similarity to MM318017
| Tanimoto metric | 0.6815 |
|---|---|
| Cosine metric | 0.8106 |
| Dice metric | 0.8106 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM320367
Similarity: 0.6619
Similarity to MM320367
| Tanimoto metric | 0.6619 |
|---|---|
| Cosine metric | 0.7969 |
| Dice metric | 0.7965 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+350 more
