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DocumentationIdentifier: MM260491
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM260491 |
| SMILES |
C=CC(C)NCC=C(C)F
|
| InChIKey |
YBTSMAWXAAAWAT-UHFFFAOYSA-N
|
| MW [Da] |
143.21
Automatically obtained from RDkit software. |
| LogP |
2.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133377
Similarity: 0.8101
Similarity to MM133377
| Tanimoto metric | 0.8101 |
|---|---|
| Cosine metric | 0.9001 |
| Dice metric | 0.8951 |
| MW: | 131.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM279412
Similarity: 0.7471
Similarity to MM279412
| Tanimoto metric | 0.7471 |
|---|---|
| Cosine metric | 0.8559 |
| Dice metric | 0.8553 |
| MW: | 143.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM167307
Similarity: 0.7089
Similarity to MM167307
| Tanimoto metric | 0.7089 |
|---|---|
| Cosine metric | 0.8419 |
| Dice metric | 0.8296 |
| MW: | 129.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+336 more
