General Information of the Compound
| Compound ID |
CP0419331
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| Compound Name |
US9216182, 1.44
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| Structure |
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| Formula |
C22H33N5O3
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| Molecular Weight |
415.538
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| Canonical SMILES |
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)N1CCCC1=O
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| InChI |
InChI=1S/C22H33N5O3/c1-17(2)24-12-14-26(15-13-24)22(29)30-19-7-10-25(11-8-19)20-6-5-18(16-23-20)27-9-3-4-21(27)28/h5-6,16-17,19H,3-4,7-15H2,1-2H3
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| InChIKey |
WOJQZPNHUXTCJS-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