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DocumentationIdentifier: MM373200
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM373200 |
| SMILES |
CC(C=O)CC1C(C)N1C
|
| InChIKey |
CKSFFQBPFLGAAV-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
MM353330
Similarity: 0.7443
Similarity to MM353330
| Tanimoto metric | 0.7443 |
|---|---|
| Cosine metric | 0.8627 |
| Dice metric | 0.8534 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM373748
Similarity: 0.6932
Similarity to MM373748
| Tanimoto metric | 0.6932 |
|---|---|
| Cosine metric | 0.8326 |
| Dice metric | 0.8188 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM353693
Similarity: 0.6735
Similarity to MM353693
| Tanimoto metric | 0.6735 |
|---|---|
| Cosine metric | 0.807 |
| Dice metric | 0.8049 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+114 more
