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DocumentationIdentifier: MM284449
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM284449 |
| SMILES |
CC(=CCF)C(C)NC=O
|
| InChIKey |
XPXGKKZQUPPMDB-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
MM305107
Similarity: 0.7727
Similarity to MM305107
| Tanimoto metric | 0.7727 |
|---|---|
| Cosine metric | 0.879 |
| Dice metric | 0.8718 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM380359
Similarity: 0.6512
Similarity to MM380359
| Tanimoto metric | 0.6512 |
|---|---|
| Cosine metric | 0.7907 |
| Dice metric | 0.7887 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM284677
Similarity: 0.6471
Similarity to MM284677
| Tanimoto metric | 0.6471 |
|---|---|
| Cosine metric | 0.787 |
| Dice metric | 0.7857 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+147 more
