General Information of the Compound
| Compound ID |
CP0443722
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| Compound Name |
5-[3-(4-fluorophenyl)-4-oxo-7-(5-phenyl-1,2-oxazol-3-yl)quinazolin-2-yl]pentanoic acid
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| Structure |
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| Formula |
C28H22FN3O4
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| Molecular Weight |
483.499
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| Canonical SMILES |
OC(=O)CCCCc1nc2cc(ccc2c(=O)n1-c1ccc(F)cc1)-c1cc(on1)-c1ccccc1
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| InChI |
InChI=1S/C28H22FN3O4/c29-20-11-13-21(14-12-20)32-26(8-4-5-9-27(33)34)30-24-16-19(10-15-22(24)28(32)35)23-17-25(36-31-23)18-6-2-1-3-7-18/h1-3,6-7,10-17H,4-5,8-9H2,(H,33,34)
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| InChIKey |
CANIBZVSWVYQDT-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