General Information of the Compound
| Compound ID |
CP0406819
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| Compound Name |
US9216182, 1.7
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| Structure |
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| Formula |
C20H31N5O3
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| Molecular Weight |
389.5
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| Canonical SMILES |
CNC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
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| InChI |
InChI=1S/C20H31N5O3/c1-15(2)23-10-12-25(13-11-23)20(27)28-17-6-8-24(9-7-17)18-5-4-16(14-22-18)19(26)21-3/h4-5,14-15,17H,6-13H2,1-3H3,(H,21,26)
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| InChIKey |
GVPMESFZKNAJPG-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