Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM86999
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM86999 |
| SMILES |
C#CC(=CCO)C(=O)NC
|
| InChIKey |
VVZPXGAIAMZXAT-UHFFFAOYSA-N
|
| MW [Da] |
139.15
Automatically obtained from RDkit software. |
| LogP |
-0.72
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM198188
Similarity: 0.7813
Similarity to MM198188
| Tanimoto metric | 0.7813 |
|---|---|
| Cosine metric | 0.8839 |
| Dice metric | 0.8772 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87033
Similarity: 0.6961
Similarity to MM87033
| Tanimoto metric | 0.6961 |
|---|---|
| Cosine metric | 0.8216 |
| Dice metric | 0.8208 |
| MW: | 137.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM391523
Similarity: 0.672
Similarity to MM391523
| Tanimoto metric | 0.672 |
|---|---|
| Cosine metric | 0.8042 |
| Dice metric | 0.8039 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+118 more
