General Information of the Compound
| Compound ID |
CP0516110
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| Compound Name |
US9216182, 1.62
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| Structure |
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| Formula |
C20H30N4O3
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| Molecular Weight |
374.485
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| Canonical SMILES |
OCc1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
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| InChI |
InChI=1S/C20H30N4O3/c25-15-16-4-5-18(14-21-16)22-8-6-19(7-9-22)27-20(26)24-12-10-23(11-13-24)17-2-1-3-17/h4-5,14,17,19,25H,1-3,6-13,15H2
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| InChIKey |
QJZBRZHFIJZDCP-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