General Information of the Compound
| Compound ID |
CP0497405
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| Compound Name |
5-Chloro-N-(2-diethylamino-ethyl)-2-methoxy-4-[3-(4-phenoxy-phenyl)-ureido]-benzamide
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| Structure |
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| Formula |
C27H31ClN4O4
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| Molecular Weight |
511.022
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| Canonical SMILES |
CCN(CC)CCNC(=O)c1cc(Cl)c(NC(=O)Nc2ccc(Oc3ccccc3)cc2)cc1OC
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| InChI |
InChI=1S/C27H31ClN4O4/c1-4-32(5-2)16-15-29-26(33)22-17-23(28)24(18-25(22)35-3)31-27(34)30-19-11-13-21(14-12-19)36-20-9-7-6-8-10-20/h6-14,17-18H,4-5,15-16H2,1-3H3,(H,29,33)(H2,30,31,34)
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| InChIKey |
GNZOJCOHOKFVIM-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