General Information of the Compound
| Compound ID |
CP0868740
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| Compound Name |
(R)-N-(2-amino-1-(thiazol-2-yl)ethyl)-5-(4-chlorophenyl)-1H-pyrrole-2-carboxamide
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| Formula |
C16H15ClN4OS
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| Molecular Weight |
346.843
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| Canonical SMILES |
NC[C@@H](NC(=O)c1ccc(-c2ccc(Cl)cc2)[nH]1)c1nccs1
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| InChI |
InChI=1S/C16H15ClN4OS/c17-11-3-1-10(2-4-11)12-5-6-13(20-12)15(22)21-14(9-18)16-19-7-8-23-16/h1-8,14,20H,9,18H2,(H,21,22)/t14-/m1/s1
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| InChIKey |
DICWHYNSYYFXSE-CQSZACIVSA-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