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DocumentationIdentifier: MM394127
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM394127 |
| SMILES |
CCN1CC1C(=O)C(C)C
|
| InChIKey |
CVYUNTOXWBCYDM-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
0.92
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM454027
Similarity: 0.7788
Similarity to MM454027
| Tanimoto metric | 0.7788 |
|---|---|
| Cosine metric | 0.8772 |
| Dice metric | 0.8757 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM396422
Similarity: 0.7115
Similarity to MM396422
| Tanimoto metric | 0.7115 |
|---|---|
| Cosine metric | 0.8352 |
| Dice metric | 0.8314 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265989
Similarity: 0.6983
Similarity to MM265989
| Tanimoto metric | 0.6983 |
|---|---|
| Cosine metric | 0.8223 |
| Dice metric | 0.8223 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+93 more
