General Information of the Compound
| Compound ID |
CP0570991
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| Compound Name |
N-benzyl-4-(phenylsulfamoyl)-N-prop-2-ynylbenzamide
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| Structure |
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| Formula |
C23H20N2O3S
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| Molecular Weight |
404.491
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| Canonical SMILES |
O=C(N(CC#C)Cc1ccccc1)c1ccc(cc1)S(=O)(=O)Nc1ccccc1
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| InChI |
InChI=1S/C23H20N2O3S/c1-2-17-25(18-19-9-5-3-6-10-19)23(26)20-13-15-22(16-14-20)29(27,28)24-21-11-7-4-8-12-21/h1,3-16,24H,17-18H2
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| InChIKey |
CVWPKKKDWKQTSH-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
Protein ID: PT02178, LIM domain kinase 1
Protein ID: PT01347, LIM domain kinase 2