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DocumentationIdentifier: MM369294
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM369294 |
| SMILES |
O=CC=CCCC(=O)CF
|
| InChIKey |
FOCKRJYQVAFBIT-UHFFFAOYSA-N
|
| MW [Da] |
144.15
Automatically obtained from RDkit software. |
| LogP |
1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM368819
Similarity: 0.8795
Similarity to MM368819
| Tanimoto metric | 0.8795 |
|---|---|
| Cosine metric | 0.9366 |
| Dice metric | 0.9359 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM167378
Similarity: 0.8765
Similarity to MM167378
| Tanimoto metric | 0.8765 |
|---|---|
| Cosine metric | 0.9362 |
| Dice metric | 0.9342 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM368821
Similarity: 0.809
Similarity to MM368821
| Tanimoto metric | 0.809 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8944 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+354 more
