General Information of the Compound
| Compound ID |
CP0953103
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| Compound Name |
2-(4-((6-(Aminomethyl)pyrimidin-4-yl)oxy)-1H-indol-1-yl)-1-(piperidin-1-yl)ethan-1-one
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| Structure |
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| Formula |
C20H23N5O2
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| Molecular Weight |
365.437
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| Canonical SMILES |
NCc1cc(Oc2cccc3c2ccn3CC(=O)N2CCCCC2)ncn1
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| InChI |
InChI=1S/C20H23N5O2/c21-12-15-11-19(23-14-22-15)27-18-6-4-5-17-16(18)7-10-25(17)13-20(26)24-8-2-1-3-9-24/h4-7,10-11,14H,1-3,8-9,12-13,21H2
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| InChIKey |
VDXDZASWIGVHLI-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