Details
Stereochemistry | ACHIRAL |
Molecular Formula | C26H36ClN3O6S.ClH |
Molecular Weight | 590.559 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC(OC)=CC(COC2=CC(N)=C(Cl)C=C2C(=O)CCC3CCN(CCNS(C)(=O)=O)CC3)=C1
InChI
InChIKey=QSMYZGMJSGUWPM-UHFFFAOYSA-N
InChI=1S/C26H36ClN3O6S.ClH/c1-34-20-12-19(13-21(14-20)35-2)17-36-26-16-24(28)23(27)15-22(26)25(31)5-4-18-6-9-30(10-7-18)11-8-29-37(3,32)33;/h12-16,18,29H,4-11,17,28H2,1-3H3;1H
Molecular Formula | C26H36ClN3O6S |
Molecular Weight | 554.099 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
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 |
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
---|---|---|---|
Target ID: CHEMBL5017 Sources: https://www.ncbi.nlm.nih.gov/pubmed/7582507 |
9.1 null [pKi] |
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:56:54 GMT 2023
by
admin
on
Sat Dec 16 08:56:54 GMT 2023
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Record UNII |
22Z87M1U21
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Record Status |
Validated (UNII)
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Record Version |
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-
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19081934
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DTXSID5042619
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22Z87M1U21
Created by
admin on Sat Dec 16 08:56:54 GMT 2023 , Edited by admin on Sat Dec 16 08:56:54 GMT 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |