General Information of the Compound
| Compound ID |
CP0559861
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| Compound Name |
5-[[(2S)-1-methylpiperazin-2-yl]methoxy]-7-(1-methylpyrazol-4-yl)pyrido[3,4-b]pyrazine
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| Structure |
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| Formula |
C17H21N7O
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| Molecular Weight |
339.403
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| Canonical SMILES |
CN1CCNC[C@H]1COc1nc(cc2nccnc12)-c1cnn(C)c1
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| InChI |
InChI=1S/C17H21N7O/c1-23-6-5-18-9-13(23)11-25-17-16-15(19-3-4-20-16)7-14(22-17)12-8-21-24(2)10-12/h3-4,7-8,10,13,18H,5-6,9,11H2,1-2H3/t13-/m0/s1
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| InChIKey |
KSBWPNWWWVOGJM-ZDUSSCGKSA-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