Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM433035
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM433035 |
| SMILES |
C=CC(=O)C1C(C=C)N1C
|
| InChIKey |
LVRGGDOSSOMYOS-UHFFFAOYSA-N
|
| MW [Da] |
137.18
Automatically obtained from RDkit software. |
| LogP |
0.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM212289
Similarity: 0.822
Similarity to MM212289
| Tanimoto metric | 0.822 |
|---|---|
| Cosine metric | 0.9066 |
| Dice metric | 0.9023 |
| MW: | 125.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM432661
Similarity: 0.7282
Similarity to MM432661
| Tanimoto metric | 0.7282 |
|---|---|
| Cosine metric | 0.843 |
| Dice metric | 0.8427 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.83 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316345
Similarity: 0.7267
Similarity to MM316345
| Tanimoto metric | 0.7267 |
|---|---|
| Cosine metric | 0.8419 |
| Dice metric | 0.8417 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+25 more
