Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C26H26FN7O2.C4H4O4.2H2O |
| Molecular Weight | 639.6315 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.O.OC(=O)\C=C/C(O)=O.CN1CCN(CC1)C2=CC=C(NC3=NC4=C(C=CN4)C(OC5=CC(NC(=O)C=C)=CC=C5)=N3)C=C2F
InChI
InChIKey=QITOONQVTOGMOJ-IUJXYRIYSA-N
InChI=1S/C26H26FN7O2.C4H4O4.2H2O/c1-3-23(35)29-17-5-4-6-19(15-17)36-25-20-9-10-28-24(20)31-26(32-25)30-18-7-8-22(21(27)16-18)34-13-11-33(2)12-14-34;5-3(6)1-2-4(7)8;;/h3-10,15-16H,1,11-14H2,2H3,(H,29,35)(H2,28,30,31,32);1-2H,(H,5,6)(H,7,8);2*1H2/b;2-1-;;
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL2363049 Sources: https://www.ncbi.nlm.nih.gov/pubmed/28414972 |
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137321960
Created by
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DE-93
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C169756
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1822357-78-7
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Y50131AMFJ
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admin on Mon Mar 31 22:59:08 GMT 2025 , Edited by admin on Mon Mar 31 22:59:08 GMT 2025
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ACTIVE MOIETY
SUBSTANCE RECORD