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DocumentationIdentifier: MM396422
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM396422 |
| SMILES |
CC(C)C(=O)C1C(C)N1C
|
| InChIKey |
AXUISGPEQYWBNR-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM454109
Similarity: 0.8228
Similarity to MM454109
| Tanimoto metric | 0.8228 |
|---|---|
| Cosine metric | 0.9071 |
| Dice metric | 0.9028 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM394127
Similarity: 0.7115
Similarity to MM394127
| Tanimoto metric | 0.7115 |
|---|---|
| Cosine metric | 0.8352 |
| Dice metric | 0.8314 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM453411
Similarity: 0.7003
Similarity to MM453411
| Tanimoto metric | 0.7003 |
|---|---|
| Cosine metric | 0.8253 |
| Dice metric | 0.8238 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+96 more
