General Information of the Compound
| Compound ID |
CP0397162
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| Compound Name |
2-(2-(2-chloro-6-fluorophenyl)-6-(2-hydroxypropan-2-yl)-1H-phenanthro[9,10-d]imidazol-9-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
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| Structure |
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| Formula |
C27H18ClF7N2O2
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| Molecular Weight |
570.892
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| Canonical SMILES |
CC(C)(O)c1ccc2c3nc([nH]c3c3ccc(cc3c2c1)C(O)(C(F)(F)F)C(F)(F)F)-c1c(F)cccc1Cl
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| InChI |
InChI=1S/C27H18ClF7N2O2/c1-24(2,38)12-6-8-14-16(10-12)17-11-13(25(39,26(30,31)32)27(33,34)35)7-9-15(17)22-21(14)36-23(37-22)20-18(28)4-3-5-19(20)29/h3-11,38-39H,1-2H3,(H,36,37)
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| InChIKey |
IOSXTTOQIDBRDM-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