Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM447118
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM447118 |
| SMILES |
CCNCCC1NC1CC
|
| InChIKey |
XDQWLRURXSNOJR-UHFFFAOYSA-N
|
| MW [Da] |
142.25
Automatically obtained from RDkit software. |
| LogP |
0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM216538
Similarity: 0.9596
Similarity to MM216538
| Tanimoto metric | 0.9596 |
|---|---|
| Cosine metric | 0.9796 |
| Dice metric | 0.9794 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM195349
Similarity: 0.8788
Similarity to MM195349
| Tanimoto metric | 0.8788 |
|---|---|
| Cosine metric | 0.9374 |
| Dice metric | 0.9355 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM124709
Similarity: 0.8081
Similarity to MM124709
| Tanimoto metric | 0.8081 |
|---|---|
| Cosine metric | 0.8989 |
| Dice metric | 0.8939 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+200 more
