General Information of the Compound
| Compound ID |
CP0545293
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| Compound Name |
8-[4-[2-(4-phenylpiperidin-1-yl)ethyl]pyrazol-1-yl]-3H-pyrido[3,4-d]pyrimidin-4-one
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| Structure |
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| Formula |
C23H24N6O
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| Molecular Weight |
400.486
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| Canonical SMILES |
O=c1[nH]cnc2c(nccc12)-n1cc(CCN2CCC(CC2)c2ccccc2)cn1
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| InChI |
InChI=1S/C23H24N6O/c30-23-20-6-10-24-22(21(20)25-16-26-23)29-15-17(14-27-29)7-11-28-12-8-19(9-13-28)18-4-2-1-3-5-18/h1-6,10,14-16,19H,7-9,11-13H2,(H,25,26,30)
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| InChIKey |
VIUFHKFDQXQPJV-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