General Information of the Compound
| Compound ID |
CP0556075
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| Compound Name |
US8993557, 29
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| Structure |
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| Formula |
C19H23N3O3
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| Molecular Weight |
341.411
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| Canonical SMILES |
Cn1ccc(C(=O)NCc2ccccc2N2CCCCC2)c(O)c1=O
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| InChI |
InChI=1S/C19H23N3O3/c1-21-12-9-15(17(23)19(21)25)18(24)20-13-14-7-3-4-8-16(14)22-10-5-2-6-11-22/h3-4,7-9,12,23H,2,5-6,10-11,13H2,1H3,(H,20,24)
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| InChIKey |
RYWFWIJSJGYZTQ-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