Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM353585
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM353585 |
| SMILES |
CCC(=O)CCC(C)CO
|
| InChIKey |
NHLIYALTYIRVLS-UHFFFAOYSA-N
|
| MW [Da] |
144.21
Automatically obtained from RDkit software. |
| LogP |
1.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250863
Similarity: 0.75
Similarity to MM250863
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.8581 |
| Dice metric | 0.8571 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM331297
Similarity: 0.7412
Similarity to MM331297
| Tanimoto metric | 0.7412 |
|---|---|
| Cosine metric | 0.8521 |
| Dice metric | 0.8514 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM367951
Similarity: 0.7283
Similarity to MM367951
| Tanimoto metric | 0.7283 |
|---|---|
| Cosine metric | 0.8432 |
| Dice metric | 0.8428 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+318 more
