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DocumentationIdentifier: MM196315
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM196315 |
| SMILES |
CNCC(N)C1NC1C
|
| InChIKey |
WNHWRNSDXKNDAN-UHFFFAOYSA-N
|
| MW [Da] |
129.21
Automatically obtained from RDkit software. |
| LogP |
-1.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM124301
Similarity: 0.8077
Similarity to MM124301
| Tanimoto metric | 0.8077 |
|---|---|
| Cosine metric | 0.8987 |
| Dice metric | 0.8936 |
| MW: | 115.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM433726
Similarity: 0.7771
Similarity to MM433726
| Tanimoto metric | 0.7771 |
|---|---|
| Cosine metric | 0.8766 |
| Dice metric | 0.8746 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM210540
Similarity: 0.731
Similarity to MM210540
| Tanimoto metric | 0.731 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8446 |
| MW: | 130.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+277 more
