General Information of the Compound
| Compound ID |
CP0385948
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| Compound Name |
N-[4-[4-(1H-pyrazol-5-ylamino)quinazolin-2-yl]phenyl]propanamide
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| Structure |
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| Formula |
C20H18N6O
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| Molecular Weight |
358.405
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| Canonical SMILES |
CCC(=O)Nc1ccc(cc1)-c1nc(Nc2cc[nH]n2)c2ccccc2n1
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| InChI |
InChI=1S/C20H18N6O/c1-2-18(27)22-14-9-7-13(8-10-14)19-23-16-6-4-3-5-15(16)20(25-19)24-17-11-12-21-26-17/h3-12H,2H2,1H3,(H,22,27)(H2,21,23,24,25,26)
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| InChIKey |
RCFHUMWIPSPLDZ-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