General Information of the Compound
| Compound ID |
CP0417039
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| Compound Name |
6-(2,6-dichlorophenyl)-2-[(2-methylspiro[1,3-dihydroisoquinoline-4,1'-cyclopropane]-7-yl)amino]-8H-pyrido[2,3-d]pyrimidin-5-one
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| Structure |
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| Formula |
C25H21Cl2N5O
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| Molecular Weight |
478.383
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| Canonical SMILES |
CN1Cc2cc(Nc3ncc4c(n3)[nH]cc(-c3c(Cl)cccc3Cl)c4=O)ccc2C2(CC2)C1
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| InChI |
InChI=1S/C25H21Cl2N5O/c1-32-12-14-9-15(5-6-18(14)25(13-32)7-8-25)30-24-29-11-17-22(33)16(10-28-23(17)31-24)21-19(26)3-2-4-20(21)27/h2-6,9-11H,7-8,12-13H2,1H3,(H2,28,29,30,31,33)
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| InChIKey |
FWAVUQBDZHENIR-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