General Information of the Compound
| Compound ID |
CP0970092
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| Compound Name |
N-cyclopropyl-3-(4-(2-fluoro-4-methoxyphenoxy)piperidin-1-yl)pyridazino[4,5-b]pyrazin-2-amine
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| Structure |
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| Formula |
C21H23FN6O2
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| Molecular Weight |
410.453
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| Canonical SMILES |
COc1ccc(OC2CCN(c3nc4cnncc4nc3NC3CC3)CC2)c(F)c1
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| InChI |
InChI=1S/C21H23FN6O2/c1-29-15-4-5-19(16(22)10-15)30-14-6-8-28(9-7-14)21-20(25-13-2-3-13)26-17-11-23-24-12-18(17)27-21/h4-5,10-14H,2-3,6-9H2,1H3,(H,25,26)
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| InChIKey |
CHGGFUGLNUBFDE-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