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DocumentationIdentifier: MM439297
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM439297 |
| SMILES |
CCN(C=N)CC1NC1C
|
| InChIKey |
YPORIEQLIZRIQF-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM184646
Similarity: 0.8024
Similarity to MM184646
| Tanimoto metric | 0.8024 |
|---|---|
| Cosine metric | 0.8958 |
| Dice metric | 0.8904 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM208445
Similarity: 0.7066
Similarity to MM208445
| Tanimoto metric | 0.7066 |
|---|---|
| Cosine metric | 0.8406 |
| Dice metric | 0.8281 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM309502
Similarity: 0.7053
Similarity to MM309502
| Tanimoto metric | 0.7053 |
|---|---|
| Cosine metric | 0.8276 |
| Dice metric | 0.8272 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+42 more
