General Information of the Compound
| Compound ID |
CP0273468
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| Compound Name |
5-(2-fluoro-4-iodoanilino)-N-(3-hydroxypropyl)pyrimidine-4-carboxamide
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| Structure |
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| Formula |
C14H14FIN4O2
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| Molecular Weight |
416.194
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| Canonical SMILES |
OCCCNC(=O)c1ncncc1Nc1ccc(I)cc1F
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| InChI |
InChI=1S/C14H14FIN4O2/c15-10-6-9(16)2-3-11(10)20-12-7-17-8-19-13(12)14(22)18-4-1-5-21/h2-3,6-8,20-21H,1,4-5H2,(H,18,22)
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| InChIKey |
UJOHMVNVNZUHCV-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