General Information of the Compound
| Compound ID |
CP0379739
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| Compound Name |
2-benzyl-5-[(4-pyrazol-1-ylphenyl)methyl]pyrazolo[4,3-c]quinolin-3-one
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| Structure |
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| Formula |
C27H21N5O
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| Molecular Weight |
431.499
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| Canonical SMILES |
O=c1n(Cc2ccccc2)nc2c1cn(Cc1ccc(cc1)-n1cccn1)c1ccccc21
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| InChI |
InChI=1S/C27H21N5O/c33-27-24-19-30(17-21-11-13-22(14-12-21)31-16-6-15-28-31)25-10-5-4-9-23(25)26(24)29-32(27)18-20-7-2-1-3-8-20/h1-16,19H,17-18H2
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| InChIKey |
KYIKABPVDUWJBE-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