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DocumentationIdentifier: MM86704
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM86704 |
| SMILES |
CNC=NC(C)(C)CNC
|
| InChIKey |
NSMNETBZUVOTTR-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM89155
Similarity: 0.7386
Similarity to MM89155
| Tanimoto metric | 0.7386 |
|---|---|
| Cosine metric | 0.8594 |
| Dice metric | 0.8497 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87573
Similarity: 0.7172
Similarity to MM87573
| Tanimoto metric | 0.7172 |
|---|---|
| Cosine metric | 0.8358 |
| Dice metric | 0.8353 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM145431
Similarity: 0.5354
Similarity to MM145431
| Tanimoto metric | 0.5354 |
|---|---|
| Cosine metric | 0.7062 |
| Dice metric | 0.6974 |
| MW: | 129.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+95 more
