General Information of the Compound
| Compound ID |
CP0489991
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| Compound Name |
N-[2-[2-(4-methoxyphenyl)-3-oxo-6-[[4-(trifluoromethyl)pyridin-2-yl]methylamino]pyrido[2,3-b]pyrazin-4-yl]ethyl]acetamide
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| Structure |
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| Formula |
C25H23F3N6O3
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| Molecular Weight |
512.492
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| Canonical SMILES |
COc1ccc(cc1)-c1nc2ccc(NCc3cc(ccn3)C(F)(F)F)nc2n(CCNC(C)=O)c1=O
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| InChI |
InChI=1S/C25H23F3N6O3/c1-15(35)29-11-12-34-23-20(32-22(24(34)36)16-3-5-19(37-2)6-4-16)7-8-21(33-23)31-14-18-13-17(9-10-30-18)25(26,27)28/h3-10,13H,11-12,14H2,1-2H3,(H,29,35)(H,31,33)
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| InChIKey |
MQCJMILDOYNHBF-UHFFFAOYSA-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