General Information of the Compound
| Compound ID |
CP0463912
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| Compound Name |
US9216182, 1.13
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| Structure |
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| Formula |
C22H34N4O4
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| Molecular Weight |
418.538
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| Canonical SMILES |
CC(C)OC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
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| InChI |
InChI=1S/C22H34N4O4/c1-16(2)24-11-13-26(14-12-24)22(28)30-19-7-9-25(10-8-19)20-6-5-18(15-23-20)21(27)29-17(3)4/h5-6,15-17,19H,7-14H2,1-4H3
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| InChIKey |
IIDWRCSIRLZSTB-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