General Information of the Compound
| Compound ID |
CP0521127
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| Compound Name |
2-Methoxy-4-[3-(2-phenoxy-phenyl)-ureido]-N-(3-piperidin-1-yl-propyl)-benzamide
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| Structure |
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| Formula |
C29H34N4O4
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| Molecular Weight |
502.615
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| Canonical SMILES |
COc1cc(NC(=O)Nc2ccccc2Oc2ccccc2)ccc1C(=O)NCCCN1CCCCC1
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| InChI |
InChI=1S/C29H34N4O4/c1-36-27-21-22(15-16-24(27)28(34)30-17-10-20-33-18-8-3-9-19-33)31-29(35)32-25-13-6-7-14-26(25)37-23-11-4-2-5-12-23/h2,4-7,11-16,21H,3,8-10,17-20H2,1H3,(H,30,34)(H2,31,32,35)
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| InChIKey |
HCVLKNZCNGIOLS-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