General Information of the Compound
| Compound ID |
CP0148607
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| Compound Name |
N-(3-imidazol-1-ylpropyl)-6-[(4-methoxyphenyl)methyl]-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C26H29N7O
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| Molecular Weight |
455.566
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| Canonical SMILES |
COc1ccc(CN2CCc3nc(nc(NCCCn4ccnc4)c3C2)-c2ccccn2)cc1
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| InChI |
InChI=1S/C26H29N7O/c1-34-21-8-6-20(7-9-21)17-33-15-10-23-22(18-33)25(29-12-4-14-32-16-13-27-19-32)31-26(30-23)24-5-2-3-11-28-24/h2-3,5-9,11,13,16,19H,4,10,12,14-15,17-18H2,1H3,(H,29,30,31)
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| InChIKey |
BPZKEJNQZHOLFN-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