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DocumentationIdentifier: MM222811
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM222811 |
| SMILES |
C=C(C)C(C)(C)C(C)(C)C
|
| InChIKey |
VDNYYJYAYYFTAQ-UHFFFAOYSA-N
|
| MW [Da] |
140.27
Automatically obtained from RDkit software. |
| LogP |
3.63
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM129846
Similarity: 0.8148
Similarity to MM129846
| Tanimoto metric | 0.8148 |
|---|---|
| Cosine metric | 0.9027 |
| Dice metric | 0.898 |
| MW: | 126.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244347
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Similarity to MM244347
| Tanimoto metric | 0.7527 |
|---|---|
| Cosine metric | 0.8589 |
| Dice metric | 0.8589 |
| MW: | 140.27 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM109048
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Similarity to MM109048
| Tanimoto metric | 0.6173 |
|---|---|
| Cosine metric | 0.7857 |
| Dice metric | 0.7634 |
| MW: | 112.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+380 more
