General Information of the Compound
| Compound ID |
CP0363208
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| Compound Name |
6-benzyl-N-[3-(4-methylpiperazin-1-yl)propyl]-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 |
C27H35N7
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| Molecular Weight |
457.626
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| Canonical SMILES |
CN1CCN(CCCNc2nc(nc3CCN(Cc4ccccc4)Cc23)-c2ccccn2)CC1
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| InChI |
InChI=1S/C27H35N7/c1-32-16-18-33(19-17-32)14-7-13-29-26-23-21-34(20-22-8-3-2-4-9-22)15-11-24(23)30-27(31-26)25-10-5-6-12-28-25/h2-6,8-10,12H,7,11,13-21H2,1H3,(H,29,30,31)
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| InChIKey |
UBUAGVQRBMLBQW-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