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DocumentationIdentifier: MM434334
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM434334 |
| SMILES |
C=CCC1CN1C(C)CN
|
| InChIKey |
QMOSNCBBPQXPLY-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM194721
Similarity: 0.8067
Similarity to MM194721
| Tanimoto metric | 0.8067 |
|---|---|
| Cosine metric | 0.8981 |
| Dice metric | 0.893 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM210623
Similarity: 0.78
Similarity to MM210623
| Tanimoto metric | 0.78 |
|---|---|
| Cosine metric | 0.8832 |
| Dice metric | 0.8764 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM424986
Similarity: 0.7358
Similarity to MM424986
| Tanimoto metric | 0.7358 |
|---|---|
| Cosine metric | 0.851 |
| Dice metric | 0.8478 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+232 more
