General Information of the Compound
| Compound ID |
CP0023011
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| Compound Name |
1-Methyl-8-{[2-(phenylcarbonyl)phenyl]amino}-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxamide
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| Structure |
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| Formula |
C24H20N6O2
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| Molecular Weight |
424.464
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| Canonical SMILES |
Cn1nc(C(N)=O)c2CCc3cnc(Nc4ccccc4C(=O)c4ccccc4)nc3-c12
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| InChI |
InChI=1S/C24H20N6O2/c1-30-21-17(20(29-30)23(25)32)12-11-15-13-26-24(28-19(15)21)27-18-10-6-5-9-16(18)22(31)14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H2,25,32)(H,26,27,28)
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| InChIKey |
NFRDZRLJAHUABL-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