General Information of the Compound
| Compound ID |
CP0579556
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| Compound Name |
N-(5-chloro-2-fluorophenyl)-2-[4-(4-methylpiperidin-1-yl)sulfonylpiperazin-1-yl]acetamide
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| Structure |
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| Formula |
C18H26ClFN4O3S
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| Molecular Weight |
432.949
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| Canonical SMILES |
CC1CCN(CC1)S(=O)(=O)N1CCN(CC(=O)Nc2cc(Cl)ccc2F)CC1
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| InChI |
InChI=1S/C18H26ClFN4O3S/c1-14-4-6-23(7-5-14)28(26,27)24-10-8-22(9-11-24)13-18(25)21-17-12-15(19)2-3-16(17)20/h2-3,12,14H,4-11,13H2,1H3,(H,21,25)
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| InChIKey |
UMRVCMYDAMDDBV-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