General Information of the Compound
| Compound ID |
CP0539164
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| Compound Name |
6-[(4-fluorophenyl)methyl-methylamino]-N-(1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
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| Structure |
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| Formula |
C15H13FN6OS
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| Molecular Weight |
344.375
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| Canonical SMILES |
CN(Cc1ccc(F)cc1)c1cc(ncn1)C(=O)Nc1nncs1
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| InChI |
InChI=1S/C15H13FN6OS/c1-22(7-10-2-4-11(16)5-3-10)13-6-12(17-8-18-13)14(23)20-15-21-19-9-24-15/h2-6,8-9H,7H2,1H3,(H,20,21,23)
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| InChIKey |
YHTGRXIQNIBUBT-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