General Information of the Compound
| Compound ID |
CP0239066
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| Compound Name |
4-[6-[[4-(dimethylamino)piperidin-1-yl]methyl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl]-1,3-dihydroindol-2-one
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| Structure |
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| Formula |
C26H32N6O2S
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| Molecular Weight |
492.649
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| Canonical SMILES |
CN(C)C1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3NC(=O)Cc23)CC1
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| InChI |
InChI=1S/C26H32N6O2S/c1-30(2)17-6-8-31(9-7-17)16-18-14-22-24(35-18)26(32-10-12-34-13-11-32)29-25(28-22)19-4-3-5-21-20(19)15-23(33)27-21/h3-5,14,17H,6-13,15-16H2,1-2H3,(H,27,33)
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| InChIKey |
TVRHTBCADJHRAD-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