General Information of the Compound
| Compound ID |
CP0562135
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| Compound Name |
N'-[(1R)-3-amino-1-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl]propyl]-N-(4-chlorophenyl)oxamide
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| Formula |
C16H19ClN4O3S
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| Molecular Weight |
382.873
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| Canonical SMILES |
Cc1nc(sc1CO)[C@@H](CCN)NC(=O)C(=O)Nc1ccc(Cl)cc1
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| InChI |
InChI=1S/C16H19ClN4O3S/c1-9-13(8-22)25-16(19-9)12(6-7-18)21-15(24)14(23)20-11-4-2-10(17)3-5-11/h2-5,12,22H,6-8,18H2,1H3,(H,20,23)(H,21,24)/t12-/m1/s1
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| InChIKey |
NLDSOZKOQLOHSS-GFCCVEGCSA-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