General Information of the Compound
| Compound ID |
CP0475911
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| Compound Name |
1-(2-ethylphenyl)-3-[3-(6-pyrrolidin-1-ylpyridin-2-yl)phenyl]urea
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| Structure |
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| Formula |
C24H26N4O
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| Molecular Weight |
386.499
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| Canonical SMILES |
CCc1ccccc1NC(=O)Nc1cccc(c1)-c1cccc(n1)N1CCCC1
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| InChI |
InChI=1S/C24H26N4O/c1-2-18-9-3-4-12-21(18)27-24(29)25-20-11-7-10-19(17-20)22-13-8-14-23(26-22)28-15-5-6-16-28/h3-4,7-14,17H,2,5-6,15-16H2,1H3,(H2,25,27,29)
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| InChIKey |
MXTAHAKRKFIVAX-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