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DocumentationIdentifier: MM308214
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308214 |
| SMILES |
N#CCNC(C=O)C(F)F
|
| InChIKey |
SVNVTWYYLOIZHB-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
-0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM333201
Similarity: 0.7963
Similarity to MM333201
| Tanimoto metric | 0.7963 |
|---|---|
| Cosine metric | 0.8924 |
| Dice metric | 0.8866 |
| MW: | 137.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM49029
Similarity: 0.6296
Similarity to MM49029
| Tanimoto metric | 0.6296 |
|---|---|
| Cosine metric | 0.7935 |
| Dice metric | 0.7727 |
| MW: | 123.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308820
Similarity: 0.6014
Similarity to MM308820
| Tanimoto metric | 0.6014 |
|---|---|
| Cosine metric | 0.7513 |
| Dice metric | 0.7511 |
| MW: | 144.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+54 more
