General Information of the Compound
| Compound ID |
CP0124002
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| Compound Name |
N-[[2-chloro-4-(tetrazol-1-yl)phenyl]methyl]-6-(3,3,3-trifluoropropoxy)pyridine-3-carboxamide
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| Structure |
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| Formula |
C17H14ClF3N6O2
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| Molecular Weight |
426.786
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| Canonical SMILES |
FC(F)(F)CCOc1ccc(cn1)C(=O)NCc1ccc(cc1Cl)-n1cnnn1
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| InChI |
InChI=1S/C17H14ClF3N6O2/c18-14-7-13(27-10-24-25-26-27)3-1-11(14)8-23-16(28)12-2-4-15(22-9-12)29-6-5-17(19,20)21/h1-4,7,9-10H,5-6,8H2,(H,23,28)
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| InChIKey |
LJFWFXNKDGUYNX-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