General Information of the Compound
| Compound ID |
CP0269601
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| Compound Name |
US9169260, 35
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| Structure |
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| Formula |
C23H24N8O2
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| Molecular Weight |
444.499
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| Canonical SMILES |
Cc1ccc(cc1)-n1nc(cc1NC(=O)c1cnn2cccnc12)C1CCN(CC1)C(N)=O
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| InChI |
InChI=1S/C23H24N8O2/c1-15-3-5-17(6-4-15)31-20(13-19(28-31)16-7-11-29(12-8-16)23(24)33)27-22(32)18-14-26-30-10-2-9-25-21(18)30/h2-6,9-10,13-14,16H,7-8,11-12H2,1H3,(H2,24,33)(H,27,32)
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| InChIKey |
WWMWJTFIQUMVHC-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