General Information of the Compound
| Compound ID |
CP0557089
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| Compound Name |
1-(6-benzylpyrimidin-4-yl)-N-(2-hydroxyethyl)-2,3-dihydroindole-4-carboxamide
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| Formula |
C22H22N4O2
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| Molecular Weight |
374.444
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| Canonical SMILES |
OCCNC(=O)c1cccc2N(CCc12)c1cc(Cc2ccccc2)ncn1
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| InChI |
InChI=1S/C22H22N4O2/c27-12-10-23-22(28)19-7-4-8-20-18(19)9-11-26(20)21-14-17(24-15-25-21)13-16-5-2-1-3-6-16/h1-8,14-15,27H,9-13H2,(H,23,28)
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| InChIKey |
UIAPOZHNQMKXTK-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