General Information of the Compound
| Compound ID |
CP0951442
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| Compound Name |
(3-((6-(Aminomethyl)pyrimidin-4-yl)oxy)phenyl)(5,6-dihydro-1,7-naphthyridin-7(8H)-yl)methanone hydrochloride
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| Structure |
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| Formula |
C20H20ClN5O2
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| Molecular Weight |
397.866
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| Canonical SMILES |
Cl.NCc1cc(Oc2cccc(C(=O)N3CCc4cccnc4C3)c2)ncn1
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| InChI |
InChI=1S/C20H19N5O2.ClH/c21-11-16-10-19(24-13-23-16)27-17-5-1-3-15(9-17)20(26)25-8-6-14-4-2-7-22-18(14)12-25;/h1-5,7,9-10,13H,6,8,11-12,21H2;1H
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| InChIKey |
YZOJDKNJDCKQDY-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