General Information of the Compound
| Compound ID |
CP0575720
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| Compound Name |
2-amino-8-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-4-(5-methylfuran-2-yl)pteridin-7-one
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| Structure |
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| Formula |
C24H27N7O3
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| Molecular Weight |
461.526
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| Canonical SMILES |
COc1ccccc1N1CCN(CCn2c3nc(N)nc(-c4ccc(C)o4)c3ncc2=O)CC1
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| InChI |
InChI=1S/C24H27N7O3/c1-16-7-8-19(34-16)21-22-23(28-24(25)27-21)31(20(32)15-26-22)14-11-29-9-12-30(13-10-29)17-5-3-4-6-18(17)33-2/h3-8,15H,9-14H2,1-2H3,(H2,25,27,28)
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| InChIKey |
KMPNQVQGQZWUNC-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