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DocumentationIdentifier: MM343585
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM343585 |
| SMILES |
CC(N)COC1(CN)CC1
|
| InChIKey |
AIQRVVZXVUILCN-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
-0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM202845
Similarity: 0.8538
Similarity to MM202845
| Tanimoto metric | 0.8538 |
|---|---|
| Cosine metric | 0.924 |
| Dice metric | 0.9212 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM202846
Similarity: 0.8538
Similarity to MM202846
| Tanimoto metric | 0.8538 |
|---|---|
| Cosine metric | 0.924 |
| Dice metric | 0.9212 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM348021
Similarity: 0.8417
Similarity to MM348021
| Tanimoto metric | 0.8417 |
|---|---|
| Cosine metric | 0.9142 |
| Dice metric | 0.9141 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+343 more
