General Information of the Compound
| Compound ID |
CP0476810
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| Compound Name |
4-benzoyl-N-(pyridin-4-ylmethyl)-1H-pyrrole-2-carboxamide
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| Structure |
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| Formula |
C18H15N3O2
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| Molecular Weight |
305.337
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| Canonical SMILES |
O=C(NCc1ccncc1)c1cc(c[nH]1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C18H15N3O2/c22-17(14-4-2-1-3-5-14)15-10-16(20-12-15)18(23)21-11-13-6-8-19-9-7-13/h1-10,12,20H,11H2,(H,21,23)
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| InChIKey |
ZCHQXDBFNDFNPJ-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