General Information of the Compound
| Compound ID |
CP0409031
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| Compound Name |
N-[2-oxo-2-(N-propan-2-ylanilino)ethyl]-N-phenyl-2-(phenylcarbamoylamino)acetamide
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| Structure |
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| Formula |
C26H28N4O3
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| Molecular Weight |
444.535
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| Canonical SMILES |
CC(C)N(C(=O)CN(C(=O)CNC(=O)Nc1ccccc1)c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C26H28N4O3/c1-20(2)30(23-16-10-5-11-17-23)25(32)19-29(22-14-8-4-9-15-22)24(31)18-27-26(33)28-21-12-6-3-7-13-21/h3-17,20H,18-19H2,1-2H3,(H2,27,28,33)
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| InChIKey |
HONVEEQHGVXUMK-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
Protein ID: PT00958, Cholecystokinin receptor type A
Protein ID: PT01124, Gastrin/cholecystokinin type B receptor