General Information of the Compound
| Compound ID |
CP0313063
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| Compound Name |
2-cyclopentyl-4-(6-phenylquinazolin-4-yl)benzoic acid
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| Formula |
C26H22N2O2
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| Molecular Weight |
394.474
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| Canonical SMILES |
OC(=O)c1ccc(cc1C1CCCC1)-c1ncnc2ccc(cc12)-c1ccccc1
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| InChI |
InChI=1S/C26H22N2O2/c29-26(30)21-12-10-20(15-22(21)18-8-4-5-9-18)25-23-14-19(17-6-2-1-3-7-17)11-13-24(23)27-16-28-25/h1-3,6-7,10-16,18H,4-5,8-9H2,(H,29,30)
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| InChIKey |
HDVBNYJXZKZVTD-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