General Information of the Compound
| Compound ID |
CP0421847
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| Compound Name |
N-(3-phenyl-1,2,4-thiadiazol-5-yl)-4-(pyrimidin-4-ylamino)benzamide
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| Structure |
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| Formula |
C19H14N6OS
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| Molecular Weight |
374.429
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| Canonical SMILES |
O=C(Nc1nc(ns1)-c1ccccc1)c1ccc(Nc2ccncn2)cc1
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| InChI |
InChI=1S/C19H14N6OS/c26-18(24-19-23-17(25-27-19)13-4-2-1-3-5-13)14-6-8-15(9-7-14)22-16-10-11-20-12-21-16/h1-12H,(H,20,21,22)(H,23,24,25,26)
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| InChIKey |
UJFGQJKBVLQBMU-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