General Information of the Compound
| Compound ID |
CP0550576
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| Compound Name |
US8993565, 109
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| Structure |
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| Formula |
C19H22N4O4
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| Molecular Weight |
370.409
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| Canonical SMILES |
Cn1c(CC(=O)N2CCc3c2cccc3O)nc(cc1=O)N1CCOCC1
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| InChI |
InChI=1S/C19H22N4O4/c1-21-16(20-17(12-18(21)25)22-7-9-27-10-8-22)11-19(26)23-6-5-13-14(23)3-2-4-15(13)24/h2-4,12,24H,5-11H2,1H3
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| InChIKey |
HUUABEHPHBBJBG-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