General Information of the Compound
| Compound ID |
CP0408009
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| Compound Name |
3-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-3-(2-methylpropyl)-1H-indol-2-one
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| Structure |
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| Formula |
C26H34ClN3O
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| Molecular Weight |
440.031
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| Canonical SMILES |
CC(C)CC1(CCCCN2CCN(CC2)c2cccc(Cl)c2)C(=O)Nc2ccccc12
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| InChI |
InChI=1S/C26H34ClN3O/c1-20(2)19-26(23-10-3-4-11-24(23)28-25(26)31)12-5-6-13-29-14-16-30(17-15-29)22-9-7-8-21(27)18-22/h3-4,7-11,18,20H,5-6,12-17,19H2,1-2H3,(H,28,31)
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| InChIKey |
WCILESILEVDHCT-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