General Information of the Compound
| Compound ID |
CP0518078
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| Compound Name |
6-[6-(4-chlorophenyl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-2-naphthalenecarboxylic acid
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| Structure |
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| Formula |
C23H13ClN2O3S
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| Molecular Weight |
432.888
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| Canonical SMILES |
OC(=O)c1ccc2cc(ccc2c1)-n1cnc2cc(sc2c1=O)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H13ClN2O3S/c24-17-6-3-13(4-7-17)20-11-19-21(30-20)22(27)26(12-25-19)18-8-5-14-9-16(23(28)29)2-1-15(14)10-18/h1-12H,(H,28,29)
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| InChIKey |
OPXZJSGFUFISKN-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