General Information of the Compound
| Compound ID |
CP0018880
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| Compound Name |
1-(1-Methylpiperidin-4-yl)-8-(phenylamino)-4,5-dihydro-1Hpyrazolo[4,3-h]quinazoline-3-carboxamide
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| Structure |
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| Formula |
C22H25N7O
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| Molecular Weight |
403.49
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| Canonical SMILES |
CN1CCC(CC1)n1nc(C(N)=O)c2CCc3cnc(Nc4ccccc4)nc3-c12
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| InChI |
InChI=1S/C22H25N7O/c1-28-11-9-16(10-12-28)29-20-17(19(27-29)21(23)30)8-7-14-13-24-22(26-18(14)20)25-15-5-3-2-4-6-15/h2-6,13,16H,7-12H2,1H3,(H2,23,30)(H,24,25,26)
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| InChIKey |
ZDEIBVDDZHUQLD-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