General Information of the Compound
| Compound ID |
CP0390843
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| Compound Name |
[1-(4-methoxynaphthalen-1-yl)sulfonyl-2,3-dihydroindol-3-yl]-piperazin-1-ylmethanone
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| Structure |
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| Formula |
C24H25N3O4S
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| Molecular Weight |
451.548
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| Canonical SMILES |
COc1ccc(c2ccccc12)S(=O)(=O)N1CC(C(=O)N2CCNCC2)c2ccccc12
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| InChI |
InChI=1S/C24H25N3O4S/c1-31-22-10-11-23(19-8-3-2-7-18(19)22)32(29,30)27-16-20(17-6-4-5-9-21(17)27)24(28)26-14-12-25-13-15-26/h2-11,20,25H,12-16H2,1H3
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| InChIKey |
HLGMXGTZZOBOSI-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