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DocumentationIdentifier: MM461735
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM461735 |
| SMILES |
CC1(C)CN1CC(=O)CO
|
| InChIKey |
HLZDDVJZSCGFRT-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
-0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM437946
Similarity: 0.8089
Similarity to MM437946
| Tanimoto metric | 0.8089 |
|---|---|
| Cosine metric | 0.8994 |
| Dice metric | 0.8944 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM461708
Similarity: 0.7834
Similarity to MM461708
| Tanimoto metric | 0.7834 |
|---|---|
| Cosine metric | 0.8851 |
| Dice metric | 0.8786 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM249780
Similarity: 0.7111
Similarity to MM249780
| Tanimoto metric | 0.7111 |
|---|---|
| Cosine metric | 0.8313 |
| Dice metric | 0.8312 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+85 more
