General Information of the Compound
| Compound ID |
CP0261645
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| Compound Name |
2-(2-(cyclohexanecarboxamido)-6-morpholino-9H-purin-9-yl)acetic acid
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| Structure |
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| Formula |
C18H24N6O4
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| Molecular Weight |
388.428
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| Canonical SMILES |
OC(=O)Cn1cnc2c(nc(NC(=O)C3CCCCC3)nc12)N1CCOCC1
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| InChI |
InChI=1S/C18H24N6O4/c25-13(26)10-24-11-19-14-15(23-6-8-28-9-7-23)20-18(21-16(14)24)22-17(27)12-4-2-1-3-5-12/h11-12H,1-10H2,(H,25,26)(H,20,21,22,27)
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| InChIKey |
YFCASXKFFIBHBP-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