Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C18H23N3O5S |
Molecular Weight | 393.457 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CN=C2)[C@H](C(C)C)C(=O)NO
InChI
InChIKey=BSIZUMJRKYHEBR-QGZVFWFLSA-N
InChI=1S/C18H23N3O5S/c1-13(2)17(18(22)20-23)21(12-14-5-4-10-19-11-14)27(24,25)16-8-6-15(26-3)7-9-16/h4-11,13,17,23H,12H2,1-3H3,(H,20,22)/t17-/m1/s1
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL1795103 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21514700 |
1.5 nM [IC50] | ||
Target ID: CHEMBL321 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21514700 |
4.8 nM [IC50] | ||
Target ID: CHEMBL4588 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21514700 |
7.7 nM [IC50] | ||
Target ID: CHEMBL283 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21514700 |
16.0 nM [IC50] | ||
Target ID: CHEMBL3869 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21514700 |
23.0 nM [IC50] |
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Code System | Code | Type | Description | ||
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446504
Created by
admin on Sat Dec 16 13:42:45 GMT 2023 , Edited by admin on Sat Dec 16 13:42:45 GMT 2023
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PRIMARY | |||
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161314-70-1
Created by
admin on Sat Dec 16 13:42:45 GMT 2023 , Edited by admin on Sat Dec 16 13:42:45 GMT 2023
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PRIMARY | |||
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80AXY59IT2
Created by
admin on Sat Dec 16 13:42:45 GMT 2023 , Edited by admin on Sat Dec 16 13:42:45 GMT 2023
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PRIMARY | |||
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DB07556
Created by
admin on Sat Dec 16 13:42:45 GMT 2023 , Edited by admin on Sat Dec 16 13:42:45 GMT 2023
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PRIMARY |
ACTIVE MOIETY
SALT/SOLVATE (PARENT)
SALT/SOLVATE (PARENT)