General Information of the Compound
| Compound ID |
CP0562771
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| Compound Name |
1-[6-[(3,5-difluorophenyl)methyl]pyrimidin-4-yl]-N-(2-hydroxyethyl)-2,3-dihydroindole-4-carboxamide
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| Formula |
C22H20F2N4O2
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| Molecular Weight |
410.424
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| Canonical SMILES |
OCCNC(=O)c1cccc2N(CCc12)c1cc(Cc2cc(F)cc(F)c2)ncn1
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| InChI |
InChI=1S/C22H20F2N4O2/c23-15-8-14(9-16(24)11-15)10-17-12-21(27-13-26-17)28-6-4-18-19(2-1-3-20(18)28)22(30)25-5-7-29/h1-3,8-9,11-13,29H,4-7,10H2,(H,25,30)
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| InChIKey |
PLZXVXXMJIKMNI-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