General Information of the Compound
| Compound ID |
CP0575007
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| Compound Name |
CHEMBL5092589
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| Formula |
C17H19F3N6O2
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| Molecular Weight |
396.373
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| Canonical SMILES |
NC(=O)c1ccc(Nc2ncc(c(N[C@H]3CC[C@H](O)CC3)n2)C(F)(F)F)cn1
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| InChI |
InChI=1S/C17H19F3N6O2/c18-17(19,20)12-8-23-16(25-10-3-6-13(14(21)28)22-7-10)26-15(12)24-9-1-4-11(27)5-2-9/h3,6-9,11,27H,1-2,4-5H2,(H2,21,28)(H2,23,24,25,26)/t9-,11-
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| InChIKey |
WOTJZQMSLYWZGS-HOMQSWHASA-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
Protein ID: PT00888, Mast/stem cell growth factor receptor Kit
Protein ID: PT01204, Receptor-type tyrosine-protein kinase FLT3