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DocumentationIdentifier: MM254492
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254492 |
| SMILES |
CC(O)CCC(F)C(C)C
|
| InChIKey |
JCVDBMYPWYKOKX-UHFFFAOYSA-N
|
| MW [Da] |
148.22
Automatically obtained from RDkit software. |
| LogP |
2.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144020
Similarity: 0.7727
Similarity to MM144020
| Tanimoto metric | 0.7727 |
|---|---|
| Cosine metric | 0.879 |
| Dice metric | 0.8718 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224642
Similarity: 0.7647
Similarity to MM224642
| Tanimoto metric | 0.7647 |
|---|---|
| Cosine metric | 0.8669 |
| Dice metric | 0.8667 |
| MW: | 148.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250479
Similarity: 0.7391
Similarity to MM250479
| Tanimoto metric | 0.7391 |
|---|---|
| Cosine metric | 0.8543 |
| Dice metric | 0.85 |
| MW: | 148.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+486 more
