General Information of the Compound
| Compound ID |
CP0353832
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| Compound Name |
N-cyclopropyl-3-[4-[(2,4-difluorophenyl)methyl]piperazin-1-yl]pyrido[3,4-b]pyrazin-2-amine
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| Structure |
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| Formula |
C21H22F2N6
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| Molecular Weight |
396.445
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| Canonical SMILES |
Fc1ccc(CN2CCN(CC2)c2nc3cnccc3nc2NC2CC2)c(F)c1
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| InChI |
InChI=1S/C21H22F2N6/c22-15-2-1-14(17(23)11-15)13-28-7-9-29(10-8-28)21-20(25-16-3-4-16)26-18-5-6-24-12-19(18)27-21/h1-2,5-6,11-12,16H,3-4,7-10,13H2,(H,25,26)
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| InChIKey |
YQURRFMFHGHBTQ-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