General Information of the Compound
| Compound ID |
CP0578320
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| Compound Name |
3-chloro-4-[4-(4-fluoro-2-methylphenoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]pyrrole-2,5-dione
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| Structure |
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| Formula |
C18H14ClFN4O3
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| Molecular Weight |
388.786
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| Canonical SMILES |
Cc1cc(F)ccc1Oc1ncnc2CN(CCc12)C1=C(Cl)C(=O)NC1=O
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| InChI |
InChI=1S/C18H14ClFN4O3/c1-9-6-10(20)2-3-13(9)27-18-11-4-5-24(7-12(11)21-8-22-18)15-14(19)16(25)23-17(15)26/h2-3,6,8H,4-5,7H2,1H3,(H,23,25,26)
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| InChIKey |
WHIMDTSXDZGYQL-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