General Information of the Compound
| Compound ID |
CP0564048
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| Compound Name |
US8741923, 27
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| Structure |
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| Formula |
C24H27N5O2
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| Molecular Weight |
417.513
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| Canonical SMILES |
CCC1CCCCN1c1ccc(cc1COC)-c1nc(no1)-c1ccc2nc[nH]c2c1
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| InChI |
InChI=1S/C24H27N5O2/c1-3-19-6-4-5-11-29(19)22-10-8-17(12-18(22)14-30-2)24-27-23(28-31-24)16-7-9-20-21(13-16)26-15-25-20/h7-10,12-13,15,19H,3-6,11,14H2,1-2H3,(H,25,26)
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| InChIKey |
PHGLJQQHANRKFV-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