General Information of the Compound
| Compound ID |
CP0547561
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| Compound Name |
4-methoxy-N-[2-(7-methoxynaphthalen-1-yl)-2-methylpropyl]-3-(4-methylpiperazin-1-yl)benzenesulfonamide
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| Structure |
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| Formula |
C27H35N3O4S
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| Molecular Weight |
497.661
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| Canonical SMILES |
COc1ccc2cccc(c2c1)C(C)(C)CNS(=O)(=O)c1ccc(OC)c(c1)N1CCN(C)CC1
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| InChI |
InChI=1S/C27H35N3O4S/c1-27(2,24-8-6-7-20-9-10-21(33-4)17-23(20)24)19-28-35(31,32)22-11-12-26(34-5)25(18-22)30-15-13-29(3)14-16-30/h6-12,17-18,28H,13-16,19H2,1-5H3
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| InChIKey |
BDIHRKKHNLTUPE-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