General Information of the Compound
| Compound ID |
CP0438415
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| Compound Name |
propan-2-yl 3-[[3,3-diphenylpropyl(2-morpholin-4-ylethyl)carbamoyl]amino]benzoate
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| Structure |
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| Formula |
C32H39N3O4
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| Molecular Weight |
529.681
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| Canonical SMILES |
CC(C)OC(=O)c1cccc(NC(=O)N(CCC(c2ccccc2)c2ccccc2)CCN2CCOCC2)c1
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| InChI |
InChI=1S/C32H39N3O4/c1-25(2)39-31(36)28-14-9-15-29(24-28)33-32(37)35(19-18-34-20-22-38-23-21-34)17-16-30(26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-15,24-25,30H,16-23H2,1-2H3,(H,33,37)
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| InChIKey |
UYPNXWQCBZHNSO-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