Chembl608740
2D Structure
3D Structure
Source:
General | |
Identifier | MM469197 |
SMILES |
CN1CCC(CN2CCN(C(=O)CC(c3ccccc3)c3ccccc3)CC2)CC1
|
InChIKey |
SNLUJUXVFVOODX-UHFFFAOYSA-N
|
MW [Da] |
405.59
Automatically obtained from RDkit software. |
LogP |
3.69
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
Chembl608740
|
Similar entries
MM20940
Similarity: 0.9839
Similarity to MM20940
Tanimoto metric | 0.9839 |
---|---|
Cosine metric | 0.9919 |
Dice metric | 0.9919 |
MW: | 391.56 |
||||
---|---|---|---|---|---|
PI: | 1
Total passive interactions
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LogP: | 3.35 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM20939
Similarity: 0.7816
Similarity to MM20939
Tanimoto metric | 0.7816 |
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Cosine metric | 0.8776 |
Dice metric | 0.8774 |
MW: | 391.56 |
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---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 3.49 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM20996
Similarity: 0.6885
Similarity to MM20996
Tanimoto metric | 0.6885 |
---|---|
Cosine metric | 0.8155 |
Dice metric | 0.8155 |
MW: | 480.57 |
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---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 5.79 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+34 more