Identifier: MM181136
2D Structure
3D Structure
Source:
General | |
Identifier | MM181136 |
SMILES |
CC(C)C(=NO)C(C)C
|
InChIKey |
PULCKIYKBGOTTG-UHFFFAOYSA-N
|
MW [Da] |
129.2
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
N-(2-methylpentan-3-ylidene)hydroxylamine
Similarity: 0.9286
Similarity to N-(2-methylpentan-3-ylidene)hydroxylamine
Tanimoto metric | 0.9286 |
---|---|
Cosine metric | 0.9636 |
Dice metric | 0.963 |
MW: | 115.18 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.88 |
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AI: | 0
Total active interactions
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N-(3-methylbutan-2-ylidene)hydroxylamine
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Similarity to N-(3-methylbutan-2-ylidene)hydroxylamine
Tanimoto metric | 0.7143 |
---|---|
Cosine metric | 0.8452 |
Dice metric | 0.8333 |
MW: | 101.15 |
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PI: | 3
Total passive interactions
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LogP: | 1.49 |
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AI: | 0
Total active interactions
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MM180294
Similarity: 0.7123
Similarity to MM180294
Tanimoto metric | 0.7123 |
---|---|
Cosine metric | 0.8365 |
Dice metric | 0.832 |
MW: | 129.2 |
||||
---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 2.27 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+359 more