General Information of the Compound
| Compound ID |
CP0430898
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| Compound Name |
N-[2-(diethylamino)ethyl]-2-methoxy-4-[(4-phenoxybenzoyl)amino]benzamide
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| Structure |
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| Formula |
C27H31N3O4
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| Molecular Weight |
461.562
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| Canonical SMILES |
CCN(CC)CCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccccc3)cc2)cc1OC
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| InChI |
InChI=1S/C27H31N3O4/c1-4-30(5-2)18-17-28-27(32)24-16-13-21(19-25(24)33-3)29-26(31)20-11-14-23(15-12-20)34-22-9-7-6-8-10-22/h6-16,19H,4-5,17-18H2,1-3H3,(H,28,32)(H,29,31)
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| InChIKey |
IZGYVBOGCUZDNQ-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