General Information of the Compound
| Compound ID |
CP0492034
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| Compound Name |
US9169260, 36
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| Structure |
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| Formula |
C23H25N7O
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| Molecular Weight |
415.501
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| Canonical SMILES |
CN1CCC(CC1)c1cc(NC(=O)c2cnn3cccnc23)n(n1)-c1ccc(C)cc1
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| InChI |
InChI=1S/C23H25N7O/c1-16-4-6-18(7-5-16)30-21(14-20(27-30)17-8-12-28(2)13-9-17)26-23(31)19-15-25-29-11-3-10-24-22(19)29/h3-7,10-11,14-15,17H,8-9,12-13H2,1-2H3,(H,26,31)
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| InChIKey |
ARXGQULYTQITKD-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