Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM383622
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM383622 |
| SMILES |
N#CC(O)C(C=O)=CCO
|
| InChIKey |
FODZAVUKVYSDND-UHFFFAOYSA-N
|
| MW [Da] |
141.13
Automatically obtained from RDkit software. |
| LogP |
-1.01
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM383620
Similarity: 0.7561
Similarity to MM383620
| Tanimoto metric | 0.7561 |
|---|---|
| Cosine metric | 0.8611 |
| Dice metric | 0.8611 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM86511
Similarity: 0.7066
Similarity to MM86511
| Tanimoto metric | 0.7066 |
|---|---|
| Cosine metric | 0.8281 |
| Dice metric | 0.8281 |
| MW: | 136.11 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM86508
Similarity: 0.6743
Similarity to MM86508
| Tanimoto metric | 0.6743 |
|---|---|
| Cosine metric | 0.8056 |
| Dice metric | 0.8055 |
| MW: | 137.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+113 more
