General Information of the Compound
| Compound ID |
CP0468857
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| Compound Name |
1-[[5-(cyclohexylmethoxy)-4-oxochromen-3-yl]methyl]-1-(2-hydroxyethyl)-3-propan-2-ylurea
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| Structure |
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| Formula |
C23H32N2O5
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| Molecular Weight |
416.518
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| Canonical SMILES |
CC(C)NC(=O)N(CCO)Cc1coc2cccc(OCC3CCCCC3)c2c1=O
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| InChI |
InChI=1S/C23H32N2O5/c1-16(2)24-23(28)25(11-12-26)13-18-15-30-20-10-6-9-19(21(20)22(18)27)29-14-17-7-4-3-5-8-17/h6,9-10,15-17,26H,3-5,7-8,11-14H2,1-2H3,(H,24,28)
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| InChIKey |
SHAURQNGTTUHTK-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