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DocumentationIdentifier: MM328645
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM328645 |
| SMILES |
N=C(CO)NC(CN)CO
|
| InChIKey |
GHWNYYROFKYXGW-UHFFFAOYSA-N
|
| MW [Da] |
147.18
Automatically obtained from RDkit software. |
| LogP |
-2.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149929
Similarity: 0.8103
Similarity to MM149929
| Tanimoto metric | 0.8103 |
|---|---|
| Cosine metric | 0.9002 |
| Dice metric | 0.8952 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142041
Similarity: 0.7586
Similarity to MM142041
| Tanimoto metric | 0.7586 |
|---|---|
| Cosine metric | 0.871 |
| Dice metric | 0.8627 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328641
Similarity: 0.704
Similarity to MM328641
| Tanimoto metric | 0.704 |
|---|---|
| Cosine metric | 0.8296 |
| Dice metric | 0.8263 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+301 more
