Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM252919
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM252919 |
| SMILES |
C=C(C#CC(N)=O)NC=O
|
| InChIKey |
ATFFRVFUBQRXHJ-UHFFFAOYSA-N
|
| MW [Da] |
138.13
Automatically obtained from RDkit software. |
| LogP |
-1.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM46983
Similarity: 0.7685
Similarity to MM46983
| Tanimoto metric | 0.7685 |
|---|---|
| Cosine metric | 0.8767 |
| Dice metric | 0.8691 |
| MW: | 123.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM237823
Similarity: 0.6324
Similarity to MM237823
| Tanimoto metric | 0.6324 |
|---|---|
| Cosine metric | 0.7751 |
| Dice metric | 0.7748 |
| MW: | 137.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM107719
Similarity: 0.6019
Similarity to MM107719
| Tanimoto metric | 0.6019 |
|---|---|
| Cosine metric | 0.7758 |
| Dice metric | 0.7514 |
| MW: | 109.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+233 more
