Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM273570
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM273570 |
| SMILES |
C#CCC(=O)C1NC1C#N
|
| InChIKey |
BQGGZRYIPSYZIQ-UHFFFAOYSA-N
|
| MW [Da] |
134.14
Automatically obtained from RDkit software. |
| LogP |
-0.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM386979
Similarity: 0.8102
Similarity to MM386979
| Tanimoto metric | 0.8102 |
|---|---|
| Cosine metric | 0.9001 |
| Dice metric | 0.8951 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263586
Similarity: 0.75
Similarity to MM263586
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 123.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268949
Similarity: 0.6378
Similarity to MM268949
| Tanimoto metric | 0.6378 |
|---|---|
| Cosine metric | 0.7794 |
| Dice metric | 0.7788 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+27 more
