General Information of the Compound
| Compound ID |
CP0390418
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| Compound Name |
8-[(1S)-1-(3-fluoroanilino)ethyl]-N-(2-hydroxyethyl)-2-morpholin-4-ylquinoxaline-6-carboxamide
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| Structure |
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| Formula |
C23H26FN5O3
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| Molecular Weight |
439.491
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| Canonical SMILES |
C[C@H](Nc1cccc(F)c1)c1cc(cc2ncc(nc12)N1CCOCC1)C(=O)NCCO
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| InChI |
InChI=1S/C23H26FN5O3/c1-15(27-18-4-2-3-17(24)13-18)19-11-16(23(31)25-5-8-30)12-20-22(19)28-21(14-26-20)29-6-9-32-10-7-29/h2-4,11-15,27,30H,5-10H2,1H3,(H,25,31)/t15-/m0/s1
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| InChIKey |
ZTTPIMYWVRADFY-HNNXBMFYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound