General Information of the Compound
| Compound ID |
CP0039897
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| Compound Name |
3-[(E)-4-(4-Dimethylamino-benzoyl)-1-methyl-1H-pyrrol-2-yl]-N-hydroxy-acrylamide
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| Structure |
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| Formula |
C17H19N3O3
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| Molecular Weight |
313.357
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| Canonical SMILES |
CN(C)c1ccc(cc1)C(=O)c1cc(\C=C\C(=O)NO)n(C)c1
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| InChI |
InChI=1S/C17H19N3O3/c1-19(2)14-6-4-12(5-7-14)17(22)13-10-15(20(3)11-13)8-9-16(21)18-23/h4-11,23H,1-3H3,(H,18,21)/b9-8+
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| InChIKey |
YYJNJTYRTHFTKU-CMDGGOBGSA-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