Details
Stereochemistry | ACHIRAL |
Molecular Formula | C20H23ClN6O2.ClH |
Molecular Weight | 451.35 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CONC(=O)C1=CC=CC=C1NC2=CC(NC3=CC(C)=NN3C(C)C)=NC=C2Cl
InChI
InChIKey=KWSGTBMHVKYZMA-UHFFFAOYSA-N
InChI=1S/C20H23ClN6O2.ClH/c1-12(2)27-19(9-13(3)25-27)24-18-10-17(15(21)11-22-18)23-16-8-6-5-7-14(16)20(28)26-29-4;/h5-12H,1-4H3,(H,26,28)(H2,22,23,24);1H
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C20H23ClN6O2 |
Molecular Weight | 414.889 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL2695 Sources: https://www.ncbi.nlm.nih.gov/pubmed/25486573 |
15.0 nM [IC50] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:36:01 GMT 2023
by
admin
on
Sat Dec 16 08:36:01 GMT 2023
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Record UNII |
4CSJ8BJ597
|
Record Status |
Validated (UNII)
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Record Version |
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-
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4CSJ8BJ597
Created by
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54589075
Created by
admin on Sat Dec 16 08:36:01 GMT 2023 , Edited by admin on Sat Dec 16 08:36:01 GMT 2023
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1416771-10-2
Created by
admin on Sat Dec 16 08:36:01 GMT 2023 , Edited by admin on Sat Dec 16 08:36:01 GMT 2023
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ACTIVE MOIETY |