General Information of the Compound
| Compound ID |
CP0554872
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| Compound Name |
N-[2-[2-(dimethylamino)ethyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]-4-(trifluoromethyl)-1,3-thiazole-2-carboxamide
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| Formula |
C19H22F3N5O2S
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| Molecular Weight |
441.479
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| Canonical SMILES |
CN(C)CCn1cc2cc(NC(=O)c3nc(cs3)C(F)(F)F)c(cc2n1)C(C)(C)O
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| InChI |
InChI=1S/C19H22F3N5O2S/c1-18(2,29)12-8-13-11(9-27(25-13)6-5-26(3)4)7-14(12)23-16(28)17-24-15(10-30-17)19(20,21)22/h7-10,29H,5-6H2,1-4H3,(H,23,28)
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| InChIKey |
XFKVPKAIRYWQSW-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