General Information of the Compound
| Compound ID |
CP0379740
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| Compound Name |
2-methyl-5-[(4-pyrazol-1-ylphenyl)methyl]pyrazolo[4,3-c]quinolin-3-one
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| Structure |
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| Formula |
C21H17N5O
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| Molecular Weight |
355.401
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| Canonical SMILES |
Cn1nc2c(cn(Cc3ccc(cc3)-n3cccn3)c3ccccc23)c1=O
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| InChI |
InChI=1S/C21H17N5O/c1-24-21(27)18-14-25(19-6-3-2-5-17(19)20(18)23-24)13-15-7-9-16(10-8-15)26-12-4-11-22-26/h2-12,14H,13H2,1H3
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| InChIKey |
DWJNUFYDSXVEAZ-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