General Information of the Compound
| Compound ID |
CP0477570
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| Compound Name |
6-[(4-fluorophenyl)methyl]-2-pyridin-2-yl-N-(3-pyrrolidin-1-ylpropyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C26H31FN6
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| Molecular Weight |
446.574
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| Canonical SMILES |
Fc1ccc(CN2CCc3nc(nc(NCCCN4CCCC4)c3C2)-c2ccccn2)cc1
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| InChI |
InChI=1S/C26H31FN6/c27-21-9-7-20(8-10-21)18-33-17-11-23-22(19-33)25(29-13-5-16-32-14-3-4-15-32)31-26(30-23)24-6-1-2-12-28-24/h1-2,6-10,12H,3-5,11,13-19H2,(H,29,30,31)
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| InChIKey |
CARULDOHJPHGLW-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