General Information of the Compound
| Compound ID |
CP0025243
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| Compound Name |
8-(Phenylamino)-1-(propan-2-yl)-4,5-dihydro-1H-pyrazolo[4,3-h]-quinazoline-3-carboxamide
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| Structure |
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| Formula |
C19H20N6O
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| Molecular Weight |
348.41
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| Canonical SMILES |
CC(C)n1nc(C(N)=O)c2CCc3cnc(Nc4ccccc4)nc3-c12
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| InChI |
InChI=1S/C19H20N6O/c1-11(2)25-17-14(16(24-25)18(20)26)9-8-12-10-21-19(23-15(12)17)22-13-6-4-3-5-7-13/h3-7,10-11H,8-9H2,1-2H3,(H2,20,26)(H,21,22,23)
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| InChIKey |
OQCYIOKKFGCDSR-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