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DocumentationIdentifier: MM231376
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM231376 |
| SMILES |
C=C(OCCN)C(C)(C)C
|
| InChIKey |
UZCAPLRDIZPVDR-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.52
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162424
Similarity: 0.8409
Similarity to MM162424
| Tanimoto metric | 0.8409 |
|---|---|
| Cosine metric | 0.917 |
| Dice metric | 0.9136 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM231375
Similarity: 0.7347
Similarity to MM231375
| Tanimoto metric | 0.7347 |
|---|---|
| Cosine metric | 0.8476 |
| Dice metric | 0.8471 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM302157
Similarity: 0.7255
Similarity to MM302157
| Tanimoto metric | 0.7255 |
|---|---|
| Cosine metric | 0.8409 |
| Dice metric | 0.8409 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+648 more
