General Information of the Compound
| Compound ID |
CP0495287
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| Compound Name |
US9428456, 2.037
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| Structure |
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| Formula |
C23H28N4O2
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| Molecular Weight |
392.503
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| Canonical SMILES |
Cc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CC2)c1
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| InChI |
InChI=1S/C23H28N4O2/c1-16-11-19(14-24-13-16)23(29)26-21-4-2-3-17(12-21)15-27-9-7-18(8-10-27)22(28)25-20-5-6-20/h2-4,11-14,18,20H,5-10,15H2,1H3,(H,25,28)(H,26,29)
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| InChIKey |
VHZDPUXZNWBBAB-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