General Information of the Compound
| Compound ID |
CP0951291
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| Compound Name |
3-(((6-(Aminomethyl)pyrimidin-4-yl)oxy)methyl)-N-((2-chloropyridin-4-yl)methyl)benzamide hydrochloride
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| Structure |
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| Formula |
C19H19Cl2N5O2
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| Molecular Weight |
420.3
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| Canonical SMILES |
Cl.NCc1cc(OCc2cccc(C(=O)NCc3ccnc(Cl)c3)c2)ncn1
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| InChI |
InChI=1S/C19H18ClN5O2.ClH/c20-17-7-13(4-5-22-17)10-23-19(26)15-3-1-2-14(6-15)11-27-18-8-16(9-21)24-12-25-18;/h1-8,12H,9-11,21H2,(H,23,26);1H
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| InChIKey |
LWWSZONBOGHURZ-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