Details
Stereochemistry | ACHIRAL |
Molecular Formula | C26H31N5O3 |
Molecular Weight | 461.556 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CN(C)CCCOC1=NC=C(C=C1)C2=CC3=C(C=C2)N=CC4=C3N(C5CCOCC5)C(=O)N4C
InChI
InChIKey=AOTRIQLYUAFVSC-UHFFFAOYSA-N
InChI=1S/C26H31N5O3/c1-29(2)11-4-12-34-24-8-6-19(16-28-24)18-5-7-22-21(15-18)25-23(17-27-22)30(3)26(32)31(25)20-9-13-33-14-10-20/h5-8,15-17,20H,4,9-14H2,1-3H3
Molecular Formula | C26H31N5O3 |
Molecular Weight | 461.556 |
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: CHEMBL3797 Sources: https://www.ncbi.nlm.nih.gov/pubmed/29683659 |
11.0 nM [IC50] | ||
Target ID: CHEMBL3797 Sources: https://www.ncbi.nlm.nih.gov/pubmed/29683659 |
0.58 nM [IC50] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:29:52 GMT 2023
by
admin
on
Sat Dec 16 10:29:52 GMT 2023
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Record UNII |
P5T0XWC07Z
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Record Status |
Validated (UNII)
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Record Version |
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Code | English |
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SUB193594
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118502708
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1821428-35-6
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admin on Sat Dec 16 10:29:52 GMT 2023 , Edited by admin on Sat Dec 16 10:29:52 GMT 2023
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100000178039
Created by
admin on Sat Dec 16 10:29:52 GMT 2023 , Edited by admin on Sat Dec 16 10:29:52 GMT 2023
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P5T0XWC07Z
Created by
admin on Sat Dec 16 10:29:52 GMT 2023 , Edited by admin on Sat Dec 16 10:29:52 GMT 2023
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C124648
Created by
admin on Sat Dec 16 10:29:52 GMT 2023 , Edited by admin on Sat Dec 16 10:29:52 GMT 2023
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Related Record | Type | Details | ||
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BINDER->LIGAND |
BINDING
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TARGET -> INHIBITOR |
IC50
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Cmax | PHARMACOKINETIC |
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DOSE PHARMACOKINETIC PHARMACOKINETIC |
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pKa | CHEMICAL |
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Biological Half-life | PHARMACOKINETIC |
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Tmax | PHARMACOKINETIC |
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