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DocumentationIdentifier: MM231876
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM231876 |
| SMILES |
CC=CC=C(F)C(C)(C)C
|
| InChIKey |
WAKPHHKIVHRROI-UHFFFAOYSA-N
|
| MW [Da] |
142.22
Automatically obtained from RDkit software. |
| LogP |
3.46
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM132285
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| Tanimoto metric | 0.8675 |
|---|---|
| Cosine metric | 0.9314 |
| Dice metric | 0.929 |
| MW: | 128.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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| Cosine metric | 0.9184 |
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||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.07 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM295493
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Similarity to MM295493
| Tanimoto metric | 0.7527 |
|---|---|
| Cosine metric | 0.859 |
| Dice metric | 0.8589 |
| MW: | 140.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+545 more
