General Information of the Compound
| Compound ID |
CP0926485
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| Compound Name |
2-(((trans)-4-((3-(4-methoxy-2-methylphenyl)-3-phenylureido)methyl)cyclohexyl)methoxy)acetic acid
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| Formula |
C25H32N2O5
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| Molecular Weight |
440.54
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| Canonical SMILES |
COc1ccc(N(C(=O)NC[C@H]2CC[C@H](COCC(=O)O)CC2)c2ccccc2)c(C)c1
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| InChI |
InChI=1S/C25H32N2O5/c1-18-14-22(31-2)12-13-23(18)27(21-6-4-3-5-7-21)25(30)26-15-19-8-10-20(11-9-19)16-32-17-24(28)29/h3-7,12-14,19-20H,8-11,15-17H2,1-2H3,(H,26,30)(H,28,29)/t19-,20-
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| InChIKey |
XSLBXRFHBBYNNI-MXVIHJGJSA-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