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DocumentationIdentifier: MM231375
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM231375 |
| SMILES |
C=C(OCCC)C(C)(C)C
|
| InChIKey |
WCVJKXUWAPUUOL-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.97
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162423
Similarity: 0.8293
Similarity to MM162423
| Tanimoto metric | 0.8293 |
|---|---|
| Cosine metric | 0.9106 |
| Dice metric | 0.9067 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224873
Similarity: 0.7816
Similarity to MM224873
| Tanimoto metric | 0.7816 |
|---|---|
| Cosine metric | 0.8789 |
| Dice metric | 0.8774 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM231421
Similarity: 0.7708
Similarity to MM231421
| Tanimoto metric | 0.7708 |
|---|---|
| Cosine metric | 0.8711 |
| Dice metric | 0.8706 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+793 more
