General Information of the Compound
| Compound ID |
CP0006616
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| Compound Name |
US10307413, Compound 30
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| Structure |
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| Formula |
C25H34N4O2
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| Molecular Weight |
422.573
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| Canonical SMILES |
CN1CCN(Cc2cccc(c2)C(=O)NCC(O)CN2CCc3ccccc3C2)CC1
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| InChI |
InChI=1S/C25H34N4O2/c1-27-11-13-28(14-12-27)17-20-5-4-8-22(15-20)25(31)26-16-24(30)19-29-10-9-21-6-2-3-7-23(21)18-29/h2-8,15,24,30H,9-14,16-19H2,1H3,(H,26,31)
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| InChIKey |
HAFZISDFDQWRER-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