Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM248493
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM248493 |
| SMILES |
CCC(=N)NC(C)=C(C)C
|
| InChIKey |
CAFGMVUAYZESRM-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143105
Similarity: 0.816
Similarity to MM143105
| Tanimoto metric | 0.816 |
|---|---|
| Cosine metric | 0.9033 |
| Dice metric | 0.8987 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM134420
Similarity: 0.768
Similarity to MM134420
| Tanimoto metric | 0.768 |
|---|---|
| Cosine metric | 0.8764 |
| Dice metric | 0.8688 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265064
Similarity: 0.6892
Similarity to MM265064
| Tanimoto metric | 0.6892 |
|---|---|
| Cosine metric | 0.816 |
| Dice metric | 0.816 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+560 more
