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DocumentationIdentifier: MM302703
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM302703 |
| SMILES |
CC(C)C1(C)NC1CC#N
|
| InChIKey |
BRJDUFPMIAWPBM-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM176972
Similarity: 0.7912
Similarity to MM176972
| Tanimoto metric | 0.7912 |
|---|---|
| Cosine metric | 0.8895 |
| Dice metric | 0.8834 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM327693
Similarity: 0.77
Similarity to MM327693
| Tanimoto metric | 0.77 |
|---|---|
| Cosine metric | 0.8705 |
| Dice metric | 0.87 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM430901
Similarity: 0.7436
Similarity to MM430901
| Tanimoto metric | 0.7436 |
|---|---|
| Cosine metric | 0.8551 |
| Dice metric | 0.8529 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+203 more
