General Information of the Compound
| Compound ID |
CP0959224
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| Compound Name |
3-((1-(2-(cyclopropylamino)pyrido[3,4-b]pyrazin-3-yl)piperidin-4-yl)oxy)benzonitrile
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| Structure |
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| Formula |
C22H22N6O
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| Molecular Weight |
386.459
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| Canonical SMILES |
N#Cc1cccc(OC2CCN(c3nc4cnccc4nc3NC3CC3)CC2)c1
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| InChI |
InChI=1S/C22H22N6O/c23-13-15-2-1-3-18(12-15)29-17-7-10-28(11-8-17)22-21(25-16-4-5-16)26-19-6-9-24-14-20(19)27-22/h1-3,6,9,12,14,16-17H,4-5,7-8,10-11H2,(H,25,26)
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| InChIKey |
ATTUAXPMXOESNB-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