Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM233436
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM233436 |
| SMILES |
C=C(C=O)C(C)(O)CCC
|
| InChIKey |
VPALCVVDONFSIN-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
1.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM137846
Similarity: 0.7748
Similarity to MM137846
| Tanimoto metric | 0.7748 |
|---|---|
| Cosine metric | 0.8802 |
| Dice metric | 0.8731 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243145
Similarity: 0.6287
Similarity to MM243145
| Tanimoto metric | 0.6287 |
|---|---|
| Cosine metric | 0.7768 |
| Dice metric | 0.7721 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM239113
Similarity: 0.595
Similarity to MM239113
| Tanimoto metric | 0.595 |
|---|---|
| Cosine metric | 0.7471 |
| Dice metric | 0.7461 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+236 more
