General Information of the Compound
| Compound ID |
CP0244231
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| Compound Name |
US9388139, 10
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| Structure |
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| Formula |
C25H24N2O5
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| Molecular Weight |
432.476
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| Canonical SMILES |
COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)C(O)=O)c1ccc(OC)c(OC)c1
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| InChI |
InChI=1S/C25H24N2O5/c1-30-20-11-6-16(7-12-20)22-15-21(18-8-13-23(31-2)24(14-18)32-3)26-27(22)19-9-4-17(5-10-19)25(28)29/h4-14,22H,15H2,1-3H3,(H,28,29)
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| InChIKey |
GGUPJZMHXUDMOC-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