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DocumentationIdentifier: MM284836
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM284836 |
| SMILES |
C=CCC(NC=O)C(C)F
|
| InChIKey |
DINGPDJJYOBULH-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
1.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172188
Similarity: 0.6596
Similarity to MM172188
| Tanimoto metric | 0.6596 |
|---|---|
| Cosine metric | 0.7978 |
| Dice metric | 0.7949 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305022
Similarity: 0.625
Similarity to MM305022
| Tanimoto metric | 0.625 |
|---|---|
| Cosine metric | 0.7695 |
| Dice metric | 0.7692 |
| MW: | 151.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295583
Similarity: 0.6051
Similarity to MM295583
| Tanimoto metric | 0.6051 |
|---|---|
| Cosine metric | 0.754 |
| Dice metric | 0.754 |
| MW: | 147.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+93 more
