General Information of the Compound
| Compound ID |
CP0380524
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| Compound Name |
N-[(R)-[5-chloro-6-[(6-methylpyridin-3-yl)amino]pyridin-3-yl]-cyclopentylmethyl]-1,3-thiazole-2-carboxamide
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| Structure |
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| Formula |
C21H22ClN5OS
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| Molecular Weight |
427.961
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| Canonical SMILES |
Cc1ccc(Nc2ncc(cc2Cl)[C@H](NC(=O)c2nccs2)C2CCCC2)cn1
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| InChI |
InChI=1S/C21H22ClN5OS/c1-13-6-7-16(12-24-13)26-19-17(22)10-15(11-25-19)18(14-4-2-3-5-14)27-20(28)21-23-8-9-29-21/h6-12,14,18H,2-5H2,1H3,(H,25,26)(H,27,28)/t18-/m1/s1
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| InChIKey |
FNGGVFCXCCMXGS-GOSISDBHSA-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