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DocumentationIdentifier: MM83947
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM83947 |
| SMILES |
C=C(C)N(C=N)C(=C)CO
|
| InChIKey |
OCZVNMUUTNICAP-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.94
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197475
Similarity: 0.7786
Similarity to MM197475
| Tanimoto metric | 0.7786 |
|---|---|
| Cosine metric | 0.8824 |
| Dice metric | 0.8755 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM94493
Similarity: 0.6456
Similarity to MM94493
| Tanimoto metric | 0.6456 |
|---|---|
| Cosine metric | 0.7846 |
| Dice metric | 0.7846 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389248
Similarity: 0.6438
Similarity to MM389248
| Tanimoto metric | 0.6438 |
|---|---|
| Cosine metric | 0.7833 |
| Dice metric | 0.7833 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+122 more
