General Information of the Compound
| Compound ID |
CP0419615
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| Compound Name |
3-[2-(4-morpholinylmethyl)-6-quinolinyl]-6-phenylthieno-[3,2-d]pyrimidin-4(3H)-one
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| Structure |
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| Formula |
C26H22N4O2S
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| Molecular Weight |
454.555
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| Canonical SMILES |
O=c1n(cnc2cc(sc12)-c1ccccc1)-c1ccc2nc(CN3CCOCC3)ccc2c1
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| InChI |
InChI=1S/C26H22N4O2S/c31-26-25-23(15-24(33-25)18-4-2-1-3-5-18)27-17-30(26)21-8-9-22-19(14-21)6-7-20(28-22)16-29-10-12-32-13-11-29/h1-9,14-15,17H,10-13,16H2
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| InChIKey |
HOLXWCGCHGCJEF-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