General Information of the Compound
| Compound ID |
CP0525451
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| Compound Name |
1-[4-[2-(difluoromethyl)benzimidazol-1-yl]-6-morpholin-4-yl-1,3,5-triazin-2-yl]piperidin-3-amine
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| Structure |
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| Formula |
C20H24F2N8O
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| Molecular Weight |
430.463
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| Canonical SMILES |
NC1CCCN(C1)c1nc(nc(n1)-n1c(nc2ccccc12)C(F)F)N1CCOCC1
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| InChI |
InChI=1S/C20H24F2N8O/c21-16(22)17-24-14-5-1-2-6-15(14)30(17)20-26-18(28-8-10-31-11-9-28)25-19(27-20)29-7-3-4-13(23)12-29/h1-2,5-6,13,16H,3-4,7-12,23H2
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| InChIKey |
YYQCTPAAXICISH-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