General Information of the Compound
| Compound ID |
CP0388136
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| Compound Name |
2-(4-benzylpiperazin-1-yl)-5,7-dimethoxychromen-4-one
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| Structure |
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| Formula |
C22H24N2O4
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| Molecular Weight |
380.444
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| Canonical SMILES |
COc1cc(OC)c2c(c1)oc(cc2=O)N1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C22H24N2O4/c1-26-17-12-19(27-2)22-18(25)14-21(28-20(22)13-17)24-10-8-23(9-11-24)15-16-6-4-3-5-7-16/h3-7,12-14H,8-11,15H2,1-2H3
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| InChIKey |
KUXJTCZFSOCGNH-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