General Information of the Compound
| Compound ID |
CP0541843
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| Compound Name |
US8829200, 35
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| Structure |
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| Formula |
C24H24N4O2
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| Molecular Weight |
400.482
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| Canonical SMILES |
COc1cncc(c1)-c1ccc2n(c(nc2c1)-c1cccc(c1)C(N)=O)C(C)(C)C
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| InChI |
InChI=1S/C24H24N4O2/c1-24(2,3)28-21-9-8-15(18-11-19(30-4)14-26-13-18)12-20(21)27-23(28)17-7-5-6-16(10-17)22(25)29/h5-14H,1-4H3,(H2,25,29)
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| InChIKey |
PCGYOZPNYZQBLI-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