Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM53921
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM53921 |
| SMILES |
CC(O)CN(C)CCCO
|
| InChIKey |
WMRLEECWAKIZQS-UHFFFAOYSA-N
|
| MW [Da] |
147.22
Automatically obtained from RDkit software. |
| LogP |
-0.32
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135102
Similarity: 0.8553
Similarity to MM135102
| Tanimoto metric | 0.8553 |
|---|---|
| Cosine metric | 0.9248 |
| Dice metric | 0.922 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM53842
Similarity: 0.8506
Similarity to MM53842
| Tanimoto metric | 0.8506 |
|---|---|
| Cosine metric | 0.9207 |
| Dice metric | 0.9193 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223093
Similarity: 0.7927
Similarity to MM223093
| Tanimoto metric | 0.7927 |
|---|---|
| Cosine metric | 0.8849 |
| Dice metric | 0.8844 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+416 more
