Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM382799
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM382799 |
| SMILES |
CCC(C)N1CC1C=O
|
| InChIKey |
SNRPMKFTGRMYGO-UHFFFAOYSA-N
|
| MW [Da] |
127.19
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM383140
Similarity: 0.9254
Similarity to MM383140
| Tanimoto metric | 0.9254 |
|---|---|
| Cosine metric | 0.962 |
| Dice metric | 0.9612 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM383142
Similarity: 0.8
Similarity to MM383142
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM383212
Similarity: 0.7581
Similarity to MM383212
| Tanimoto metric | 0.7581 |
|---|---|
| Cosine metric | 0.8707 |
| Dice metric | 0.8624 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+113 more
