General Information of the Compound
Compound ID |
CP0524762
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Compound Name |
2-(pyridin-3-yl)-N-m-tolyl-4-o-tolyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carboxamide
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Structure |
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Formula |
C27H25N5O
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Molecular Weight |
435.531
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Canonical SMILES |
Cc1cccc(NC(=O)N2CCc3nc(nc(c3C2)-c2ccccc2C)-c2cccnc2)c1
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InChI |
InChI=1S/C27H25N5O/c1-18-7-5-10-21(15-18)29-27(33)32-14-12-24-23(17-32)25(22-11-4-3-8-19(22)2)31-26(30-24)20-9-6-13-28-16-20/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,29,33)
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InChIKey |
GOKMEAAWGZYTFZ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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