General Information of the Compound
| Compound ID |
CP0439476
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| Compound Name |
4-[[4-[(2-methylbenzoyl)amino]naphthalen-1-yl]sulfonylamino]-N-propan-2-ylpiperidine-1-carboxamide
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| Structure |
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| Formula |
C27H32N4O4S
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| Molecular Weight |
508.644
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| Canonical SMILES |
CC(C)NC(=O)N1CCC(CC1)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2C)c2ccccc12
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| InChI |
InChI=1S/C27H32N4O4S/c1-18(2)28-27(33)31-16-14-20(15-17-31)30-36(34,35)25-13-12-24(22-10-6-7-11-23(22)25)29-26(32)21-9-5-4-8-19(21)3/h4-13,18,20,30H,14-17H2,1-3H3,(H,28,33)(H,29,32)
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| InChIKey |
BCPVJZZVPJKYEL-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