Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM362849
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM362849 |
| SMILES |
CCCNCCC(N)CO
|
| InChIKey |
XKPZHXNHQWQQDH-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
-0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM362851
Similarity: 0.8718
Similarity to MM362851
| Tanimoto metric | 0.8718 |
|---|---|
| Cosine metric | 0.9323 |
| Dice metric | 0.9315 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM112545
Similarity: 0.7714
Similarity to MM112545
| Tanimoto metric | 0.7714 |
|---|---|
| Cosine metric | 0.8783 |
| Dice metric | 0.871 |
| MW: | 118.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402011
Similarity: 0.7416
Similarity to MM402011
| Tanimoto metric | 0.7416 |
|---|---|
| Cosine metric | 0.8556 |
| Dice metric | 0.8516 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+589 more
