General Information of the Compound
| Compound ID |
CP0523462
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| Compound Name |
4-[4-(3-chlorophenyl)piperazin-1-yl]-2-phenylquinazoline
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| Structure |
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| Formula |
C24H21ClN4
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| Molecular Weight |
400.913
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| Canonical SMILES |
Clc1cccc(c1)N1CCN(CC1)c1nc(nc2ccccc12)-c1ccccc1
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| InChI |
InChI=1S/C24H21ClN4/c25-19-9-6-10-20(17-19)28-13-15-29(16-14-28)24-21-11-4-5-12-22(21)26-23(27-24)18-7-2-1-3-8-18/h1-12,17H,13-16H2
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| InChIKey |
KBBKNJGHCAIRMK-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