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DocumentationIdentifier: MM309042
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM309042 |
| SMILES |
CC1NC1CC(N)CCN
|
| InChIKey |
ZPRPGUDDCOOBQD-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
-0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM184513
Similarity: 0.8983
Similarity to MM184513
| Tanimoto metric | 0.8983 |
|---|---|
| Cosine metric | 0.9478 |
| Dice metric | 0.9464 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309040
Similarity: 0.8852
Similarity to MM309040
| Tanimoto metric | 0.8852 |
|---|---|
| Cosine metric | 0.9395 |
| Dice metric | 0.9391 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM438082
Similarity: 0.8618
Similarity to MM438082
| Tanimoto metric | 0.8618 |
|---|---|
| Cosine metric | 0.9262 |
| Dice metric | 0.9258 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+234 more
